data_1wnj_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1wnj _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 122.614 1.197 . . . . 0.0 108.105 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.6 m -83.72 172.64 12.05 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.417 2.287 . . . . 0.0 107.538 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.513 ' HG3' ' H ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -150.14 -177.12 5.74 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 119.908 -1.745 . . . . 0.0 111.298 -175.407 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.513 ' H ' ' HG3' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -142.8 146.75 21.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 C-N-CA 127.312 2.245 . . . . 0.0 105.384 175.073 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -92.07 83.42 5.13 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 102.167 -3.271 . . . . 0.0 102.167 174.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.9 pttt -58.22 -33.48 69.37 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-O 117.167 -1.397 . . . . 0.0 113.064 -175.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -78.03 -44.26 27.0 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 120.354 1.434 . . . . 0.0 110.353 -176.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.8 -40.06 94.61 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 119.249 0.932 . . . . 0.0 110.537 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 62.0 m -72.45 -34.8 68.01 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.45 -0.781 . . . . 0.0 110.625 178.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.98 -35.97 74.1 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.904 175.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.14 -54.15 49.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 119.071 0.851 . . . . 0.0 109.997 -176.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.46 -40.96 85.35 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.665 0.666 . . . . 0.0 111.297 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -50.62 -47.89 58.18 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.264 0.626 . . . . 0.0 110.781 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -54.66 -41.04 69.67 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.899 1.28 . . . . 0.0 111.636 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 mp -68.81 -61.52 1.77 Allowed 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 124.183 0.993 . . . . 0.0 110.697 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.3 t -55.83 -31.55 30.19 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.783 -175.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -29.98 67.83 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.617 1.099 . . . . 0.0 111.916 175.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -85.6 125.84 33.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.665 1.121 . . . . 0.0 112.546 -175.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -61.79 -15.8 44.5 Favored 'General case' 0 C--N 1.344 0.346 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 175.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.91 -9.37 57.35 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 125.286 1.422 . . . . 0.0 112.61 176.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.0 t -66.8 127.08 31.11 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 120.338 2.069 . . . . 0.0 108.162 175.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.8 -32.73 73.97 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.7 t -72.57 123.69 27.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 104.424 -2.436 . . . . 0.0 104.424 175.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -113.29 -25.27 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 C-N-CA 123.33 0.652 . . . . 0.0 109.974 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 24.7 p-90 -126.03 145.87 50.13 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 121.838 0.828 . . . . 0.0 109.418 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.0 t -138.33 159.97 31.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 127.664 2.386 . . . . 0.0 106.024 175.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 35.4 p -120.2 153.54 36.12 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 175.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -122.3 123.7 42.03 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 104.805 -2.295 . . . . 0.0 104.805 175.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 41.6 mmtt -102.37 176.46 5.17 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.538 1.935 . . . . 0.0 105.999 -177.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -126.44 152.32 46.56 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 175.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -146.63 163.92 34.3 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 125.888 1.675 . . . . 0.0 107.564 175.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 24.36 -88.18 0.01 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 128.51 2.957 . . . . 0.0 115.311 178.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 27.0 p -136.12 26.74 3.23 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.726 1.211 . . . . 0.0 110.154 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -142.53 157.24 44.94 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -175.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 1.8 mp -84.99 142.95 12.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 N-CA-C 103.935 -2.617 . . . . 0.0 103.935 175.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.46 161.72 57.34 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 125.398 1.479 . . . . 0.0 110.206 -177.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -71.41 152.89 61.02 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 121.572 1.515 . . . . 0.0 110.169 175.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -120.86 -152.37 8.82 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 126.103 1.811 . . . . 0.0 109.767 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.19 163.11 10.74 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.243 1.417 . . . . 0.0 110.458 175.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -141.77 161.19 38.56 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 126.455 1.902 . . . . 0.0 109.429 177.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -176.09 -179.66 46.68 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-O 121.981 0.767 . . . . 0.0 112.623 177.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.6 -13.93 9.13 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.433 1.493 . . . . 0.0 112.534 -176.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -120.73 130.98 54.28 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.524 1.13 . . . . 0.0 107.958 -175.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -83.48 -13.08 55.45 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -175.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -57.81 -43.48 85.75 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 119.776 -1.827 . . . . 0.0 109.635 175.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -68.85 -21.93 64.25 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 119.048 -0.501 . . . . 0.0 111.585 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -61.45 -43.86 98.12 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 120.373 1.442 . . . . 0.0 107.9 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.3 mm -56.71 -47.27 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 123.475 0.71 . . . . 0.0 109.268 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -61.2 -40.25 93.27 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.527 0.731 . . . . 0.0 111.315 -177.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -69.87 -23.33 63.24 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 125.528 1.531 . . . . 0.0 113.894 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.5 m -65.23 113.55 4.08 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 176.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.301 2.1 p -91.07 -174.43 3.98 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.039 2.135 . . . . 0.0 111.746 -176.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -81.26 -75.95 0.26 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -175.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -95.19 -25.41 16.4 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 -175.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 8.4 m -63.72 149.2 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 O-C-N 120.706 -1.246 . . . . 0.0 108.569 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -103.28 129.44 50.28 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 103.174 -2.899 . . . . 0.0 103.174 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.3 tp -130.0 160.59 33.19 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -130.82 153.34 49.19 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 175.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -138.8 158.73 43.68 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.466 0.65 . . . . 0.0 110.338 175.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -129.64 123.48 31.33 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 103.88 -2.637 . . . . 0.0 103.88 177.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.3 t -134.53 135.34 53.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -175.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 59.5 ttp85 -80.64 123.63 28.31 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 104.883 -2.266 . . . . 0.0 104.883 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -135.26 123.83 23.57 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.278 1.037 . . . . 0.0 110.248 -175.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 26.8 m . . . . . 0 C--N 1.317 -0.816 0 C-N-CA 124.364 1.066 . . . . 0.0 111.589 -175.527 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.5 m . . . . . 0 N--CA 1.448 -0.543 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -63.21 157.81 21.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.327 0.585 . . . . 0.0 110.706 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.1 mtt-85 -141.86 155.54 45.54 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 105.05 -2.204 . . . . 0.0 105.05 175.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 t -144.25 160.85 40.29 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.4 mtpt -145.81 176.47 9.64 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 126.395 1.878 . . . . 0.0 108.795 -175.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -135.68 140.4 44.44 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -121.19 117.82 28.09 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.965 1.706 . . . . 0.0 107.222 -176.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -87.97 113.58 23.76 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 105.091 -2.188 . . . . 0.0 105.091 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.7 mt -104.4 143.2 16.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 -176.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -123.94 123.71 41.01 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 175.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -96.49 123.75 40.26 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 125.766 1.626 . . . . 0.0 106.731 175.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.4 mt -143.4 97.38 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 176.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -60.64 169.73 8.26 Favored Glycine 0 CA--C 1.537 1.431 0 CA-C-N 119.816 1.189 . . . . 0.0 112.101 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -76.96 -12.39 59.94 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 119.991 -1.888 . . . . 0.0 109.978 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -83.15 -29.69 28.45 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 120.207 -1.558 . . . . 0.0 112.511 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.7 125.35 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 CA-C-O 121.586 0.708 . . . . 0.0 111.831 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 18.9 t -64.85 150.27 47.97 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 124.529 1.131 . . . . 0.0 110.681 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.45 -28.01 58.94 Favored Glycine 0 CA--C 1.521 0.448 0 C-N-CA 125.339 1.447 . . . . 0.0 113.913 -178.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.6 tt -59.2 -37.35 77.24 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.116 1.458 . . . . 0.0 110.241 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -73.76 -43.82 57.91 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 121.266 -0.896 . . . . 0.0 109.073 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -57.27 -28.93 63.42 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.847 -0.597 . . . . 0.0 110.359 177.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.74 -44.38 97.01 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 119.599 1.091 . . . . 0.0 109.703 176.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.07 -54.98 40.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 118.014 -0.994 . . . . 0.0 108.331 175.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 59.7 m -50.58 -39.63 50.18 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.925 0.89 . . . . 0.0 110.112 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.04 -26.4 74.03 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 118.562 -1.132 . . . . 0.0 113.745 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.1 m -105.07 -0.41 26.72 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.627 1.571 . . . . 0.0 110.981 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -103.96 -24.16 13.27 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 124.809 1.244 . . . . 0.0 110.084 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.416 ' HZ2' ' CG2' ' A' ' 116' ' ' VAL . 37.0 mttt -52.57 -37.96 58.99 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 119.883 1.22 . . . . 0.0 111.5 175.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.1 t -56.82 -41.68 78.25 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.067 0.849 . . . . 0.0 110.393 175.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 28.4 mt -64.18 -64.74 0.8 Allowed 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 125.871 1.668 . . . . 0.0 109.685 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -57.51 -30.76 37.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 117.852 -1.071 . . . . 0.0 110.257 175.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -65.42 -31.35 72.41 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 120.739 1.609 . . . . 0.0 110.468 176.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -63.52 -23.8 67.55 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 121.112 1.778 . . . . 0.0 111.966 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 81.1 t -85.55 -53.82 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 175.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 53.7 t -78.28 25.9 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 128.012 2.525 . . . . 0.0 111.993 -175.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -58.07 -25.65 61.53 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 120.031 -1.668 . . . . 0.0 109.864 175.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.01 67.8 4.8 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.298 1.839 . . . . 0.0 106.688 175.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.12 174.53 11.23 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 121.157 -0.964 . . . . 0.0 111.778 179.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -110.27 -47.63 3.27 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.761 0.825 . . . . 0.0 110.868 -176.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.2 mptt -158.7 174.68 14.67 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 128.414 2.686 . . . . 0.0 107.486 175.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -120.19 163.19 18.11 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.081 1.752 . . . . 0.0 109.661 176.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -140.54 156.64 46.25 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 103.744 -2.688 . . . . 0.0 103.744 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.416 ' CG2' ' HZ2' ' A' ' 101' ' ' LYS . 90.8 t -132.58 127.97 57.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.5 mp -134.07 145.86 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 125.958 1.703 . . . . 0.0 109.21 -175.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 78.3 p -138.9 -5.9 1.48 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 126.664 1.985 . . . . 0.0 114.032 -175.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -141.54 153.94 45.17 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 119.227 0.921 . . . . 0.0 109.542 -176.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -37.94 89.22 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.954 -1.092 . . . . 0.0 111.523 -178.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 8.0 mttp -66.05 -31.14 71.85 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 124.745 1.218 . . . . 0.0 110.315 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -77.37 -23.39 50.81 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.448 1.899 . . . . 0.0 110.208 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -82.9 -23.13 33.69 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 127.025 2.13 . . . . 0.0 112.658 -178.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -57.9 123.47 15.92 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.183 0.901 . . . . 0.0 111.728 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.8 -23.98 55.09 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 115.639 1.718 . . . . 0.0 115.639 177.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -61.12 -55.61 30.49 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -174.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -74.58 -26.26 59.81 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 117.632 -1.627 . . . . 0.0 109.662 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 54.0 mt -56.86 -34.66 44.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 124.652 1.181 . . . . 0.0 109.144 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 38.9 mttt -55.79 -55.4 32.86 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 120.172 1.351 . . . . 0.0 110.063 175.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 5.2 t -67.98 -34.91 77.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.501 0.32 . . . . 0.0 110.507 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.482 ' CD ' ' HZ3' ' A' ' 134' ' ' LYS . 7.4 tp10 -63.63 -42.42 98.15 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.227 -0.921 . . . . 0.0 109.236 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 56.4 mt -69.95 -23.52 63.2 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.167 1.387 . . . . 0.0 111.45 175.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -74.89 -51.02 14.93 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 174.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.482 ' HZ3' ' CD ' ' A' ' 131' ' ' GLU . 40.7 mtpt -53.24 -56.73 14.16 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.025 1.33 . . . . 0.0 109.765 175.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.341 0 C-N-CA 123.892 0.877 . . . . 0.0 112.656 178.155 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.48 0 CA-C-O 121.298 0.57 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m -66.99 165.59 15.31 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -123.93 -176.13 3.4 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.526 -1.359 . . . . 0.0 111.327 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -143.64 156.62 16.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 124.002 0.921 . . . . 0.0 110.45 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -100.79 85.74 2.95 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 102.587 -3.116 . . . . 0.0 102.587 174.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -65.46 -32.26 73.78 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 117.927 -1.035 . . . . 0.0 111.962 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -67.76 -50.49 56.85 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.847 1.203 . . . . 0.0 109.815 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.03 -45.9 76.06 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -177.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.7 m -72.31 -30.86 65.18 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 118.754 -0.641 . . . . 0.0 111.297 -177.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 51.1 ttm-85 -67.34 -31.99 72.62 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 116.952 -1.499 . . . . 0.0 108.84 175.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.09 -60.0 3.99 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 120.494 1.497 . . . . 0.0 109.744 -178.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.98 -38.86 89.61 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.171 0.442 . . . . 0.0 111.529 -177.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -56.5 -41.69 77.11 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 122.736 0.414 . . . . 0.0 110.219 176.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -62.03 -45.93 91.4 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 124.61 1.164 . . . . 0.0 110.27 -177.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.84 -59.8 4.86 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 175.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.5 t -60.96 -26.1 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 CA-C-O 117.93 -1.033 . . . . 0.0 111.236 -176.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.7 ttt85 -66.79 -39.47 87.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 119.933 1.242 . . . . 0.0 110.097 175.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -64.92 123.9 20.63 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.0 -29.16 67.04 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.499 1.119 . . . . 0.0 111.111 176.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.17 -10.13 66.53 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 118.135 -1.369 . . . . 0.0 114.177 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.5 t -71.21 135.62 47.62 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 120.292 2.046 . . . . 0.0 108.05 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.01 -25.99 67.97 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.502 175.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.0 t -75.48 123.69 31.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 105.98 -1.859 . . . . 0.0 105.98 175.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.03 -25.12 3.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 C-N-CA 123.125 0.57 . . . . 0.0 110.333 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.1 p-90 -125.33 147.21 49.23 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 119.113 0.869 . . . . 0.0 109.25 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.5 t -139.83 162.96 25.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 128.032 2.533 . . . . 0.0 107.306 178.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.478 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 80.7 p -128.33 161.55 29.15 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 175.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -133.6 123.69 25.54 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.5 mmtt -94.37 176.41 6.31 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 176.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -118.93 142.9 47.36 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 175.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -137.1 152.48 50.05 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 175.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 32.86 -98.96 0.01 OUTLIER Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.629 2.061 . . . . 0.0 113.646 176.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.29 39.44 3.25 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.058 1.743 . . . . 0.0 110.467 176.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -142.08 175.69 9.54 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.508 1.123 . . . . 0.0 111.503 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 32.0 mm -107.31 135.52 45.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 104.729 -2.322 . . . . 0.0 104.729 175.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.4 m -129.47 158.05 74.48 Favored Pre-proline 0 N--CA 1.47 0.532 0 CA-C-O 118.741 -0.647 . . . . 0.0 110.472 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.71 165.4 32.84 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 121.962 1.775 . . . . 0.0 110.355 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -134.16 -157.86 8.35 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 125.485 1.517 . . . . 0.0 110.557 176.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.8 mp0 -59.03 158.44 8.57 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 125.212 1.405 . . . . 0.0 109.398 176.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -156.78 155.59 31.84 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.768 1.227 . . . . 0.0 108.107 -176.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.7 -179.15 40.73 Favored Glycine 0 CA--C 1.527 0.782 0 CA-C-O 121.589 0.549 . . . . 0.0 113.156 -175.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.85 -26.24 11.33 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.101 1.36 . . . . 0.0 112.186 177.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -111.77 128.94 56.25 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 -175.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -83.08 -10.61 58.61 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.611 1.964 . . . . 0.0 113.11 -175.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -53.96 -37.98 64.49 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 120.06 1.3 . . . . 0.0 110.572 175.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -69.01 -34.06 74.65 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.413 1.085 . . . . 0.0 111.602 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -58.48 -39.23 79.41 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.559 1.144 . . . . 0.0 109.51 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.9 mm -59.79 -32.55 49.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 123.874 0.87 . . . . 0.0 109.173 -176.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -79.31 -24.05 43.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.034 1.334 . . . . 0.0 112.441 -176.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -80.94 -23.55 38.77 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.634 1.174 . . . . 0.0 112.609 -175.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 79.6 m -79.39 114.47 18.35 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.777 1.231 . . . . 0.0 108.918 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.2 p -130.16 -173.6 3.09 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 122.475 1.131 . . . . 0.0 111.259 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.488 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 9.6 p-10 -40.77 -76.57 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.49 1 C-N-CA 134.673 5.189 . . . . 0.0 117.67 -175.862 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.488 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 17.2 t70 -106.21 -6.46 18.47 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 125.958 1.703 . . . . 0.0 114.077 -175.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.8 m -68.69 131.32 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 O-C-N 120.816 -1.177 . . . . 0.0 110.063 -176.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.6 ptt-85 -103.95 123.51 47.3 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 101.216 -3.624 . . . . 0.0 101.216 175.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.6 tp -141.76 163.21 33.53 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 123.619 0.767 . . . . 0.0 110.01 -175.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -131.48 152.12 50.98 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.478 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -142.32 163.75 32.02 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.315 0.579 . . . . 0.0 111.274 176.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -138.06 123.68 19.75 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 105.3 -2.111 . . . . 0.0 105.3 -176.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.0 t -133.72 138.46 50.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -175.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.1 ttp-105 -80.91 114.9 20.11 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 175.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -131.85 133.33 44.53 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.615 1.166 . . . . 0.0 108.986 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 122.232 1.015 . . . . 0.0 111.034 -176.507 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 69.3 m . . . . . 0 N--CA 1.446 -0.652 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.3 mmtm -64.5 167.73 6.71 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.49 1.138 . . . . 0.0 112.82 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.48 148.12 42.25 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 175.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.6 t -146.51 123.92 11.67 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 104.513 -2.403 . . . . 0.0 104.513 175.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.6 mttt -135.93 176.37 8.75 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -175.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -132.31 127.17 35.03 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.037 -176.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.57 117.76 34.84 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.883 1.673 . . . . 0.0 106.82 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -87.11 113.31 22.75 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 104.3 -2.481 . . . . 0.0 104.3 175.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mt -98.23 146.55 7.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 -176.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.2 m -126.03 123.58 38.76 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 103.317 -2.846 . . . . 0.0 103.317 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 25.6 t-105 -103.28 123.46 46.82 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 175.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 13.3 mm -143.03 101.44 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 105.386 -2.079 . . . . 0.0 105.386 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -60.42 154.63 33.85 Favored Glycine 0 CA--C 1.535 1.303 0 N-CA-C 108.329 -1.909 . . . . 0.0 108.329 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -74.57 -3.35 30.51 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 120.342 -1.681 . . . . 0.0 111.177 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -82.95 -36.01 25.52 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 120.833 -1.167 . . . . 0.0 109.248 -175.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -70.91 123.82 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 104.921 -2.252 . . . . 0.0 104.921 175.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.9 t -78.52 171.74 14.68 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 122.759 1.266 . . . . 0.0 113.547 -174.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -46.84 -35.36 7.76 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 129.12 3.248 . . . . 0.0 113.661 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 tt -62.49 -57.38 11.41 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 119.937 1.869 . . . . 0.0 110.719 176.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -66.1 -37.77 86.59 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 121.774 -0.579 . . . . 0.0 109.885 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -61.41 -33.1 73.13 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.832 -0.542 . . . . 0.0 110.012 175.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.4 -28.63 69.92 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 117.952 -1.023 . . . . 0.0 111.156 176.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -63.06 -55.47 25.2 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 175.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.0 m -50.33 -47.28 55.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.769 0.827 . . . . 0.0 109.764 175.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -59.62 -25.73 61.42 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.026 0.822 . . . . 0.0 114.263 178.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 49.5 m -103.12 -9.41 19.71 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 127.82 2.448 . . . . 0.0 111.155 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -104.52 -23.56 13.12 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 127.118 2.167 . . . . 0.0 112.238 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -48.36 -36.67 14.97 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 119.896 1.226 . . . . 0.0 113.061 176.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.0 t -59.76 -34.2 72.68 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 15.4 mt -68.33 -61.66 1.74 Allowed 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 126.616 1.966 . . . . 0.0 109.963 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.2 p -61.84 -30.4 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 117.502 -1.237 . . . . 0.0 108.489 175.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -41.69 99.52 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 120.76 1.618 . . . . 0.0 109.23 175.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -58.91 -25.63 63.58 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.46 1.027 . . . . 0.0 112.806 177.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 29.9 t -86.04 -54.07 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 59.1 t -76.09 21.93 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 C-N-CA 128.753 2.821 . . . . 0.0 112.218 -175.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -48.83 -22.76 0.88 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.862 1.665 . . . . 0.0 115.309 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -107.29 85.21 2.09 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -147.51 175.26 10.98 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.351 1.86 . . . . 0.0 108.524 176.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.14 -60.37 1.62 Allowed 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -175.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.49 173.76 12.01 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.873 1.269 . . . . 0.0 110.325 -178.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -126.59 158.62 35.78 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.452 1.101 . . . . 0.0 111.034 175.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -138.53 155.42 48.41 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 104.949 -2.241 . . . . 0.0 104.949 -175.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 46.8 t -128.53 130.11 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 175.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.5 mp -132.65 153.15 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 126.468 1.907 . . . . 0.0 107.099 -176.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.6 p -149.26 -9.85 0.32 Allowed 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.451 1.901 . . . . 0.0 114.443 -175.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -129.9 154.92 46.83 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.211 1.005 . . . . 0.0 110.756 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.544 HH12 ' CD ' ' A' ' 124' ' ' GLU . 0.0 OUTLIER -69.49 -29.75 67.47 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.587 -176.586 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -76.48 -46.59 26.11 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 121.501 1.955 . . . . 0.0 107.096 174.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -55.34 -23.9 26.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.916 2.087 . . . . 0.0 112.258 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -79.66 -22.87 42.98 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.747 1.619 . . . . 0.0 113.709 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.544 ' CD ' HH12 ' A' ' 120' ' ' ARG . 18.8 mt-10 -69.74 129.04 38.5 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 116.031 1.863 . . . . 0.0 116.031 -175.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.423 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 14.2 mm-40 -53.09 -17.47 1.58 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 125.538 1.535 . . . . 0.0 114.849 175.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.408 ' HA ' ' NZ ' ' A' ' 129' ' ' LYS 0.36 15.3 t70 -65.11 -57.95 7.29 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 117.657 -1.617 . . . . 0.0 112.756 -175.605 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -77.69 -26.3 50.14 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 117.949 -1.5 . . . . 0.0 109.907 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.423 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 51.7 mt -56.53 -40.89 71.07 Favored 'Isoleucine or valine' 0 C--N 1.344 0.345 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.408 ' NZ ' ' HA ' ' A' ' 126' ' ' ASP . 28.1 mtmm -52.85 -52.35 57.58 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 119.905 1.229 . . . . 0.0 111.283 176.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.2 t -73.79 -24.19 59.8 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.622 -178.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -67.63 -49.75 61.42 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 175.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.01 -23.9 62.34 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.29 1.036 . . . . 0.0 111.092 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -67.5 -52.93 33.3 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 174.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -53.73 -48.82 69.27 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.588 1.085 . . . . 0.0 110.103 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.455 0 C-N-CA 124.415 1.086 . . . . 0.0 112.378 -179.391 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.384 0 N-CA-C 105.424 -2.065 . . . . 0.0 105.424 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.4 m -134.29 165.24 25.58 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.035 1.734 . . . . 0.0 106.412 -175.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -128.03 178.45 6.19 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.115 -0.991 . . . . 0.0 111.006 -175.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.19 151.35 24.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 122.732 0.413 . . . . 0.0 110.095 176.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -99.74 77.73 2.08 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 103.076 -2.935 . . . . 0.0 103.076 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -24.13 66.46 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.027 -1.463 . . . . 0.0 110.47 -175.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -66.46 -59.88 3.26 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 120.228 1.377 . . . . 0.0 109.799 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.62 93.15 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.979 0.912 . . . . 0.0 109.853 -178.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 62.5 m -66.78 -36.94 83.58 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.361 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 68.9 ttt-85 -63.7 -35.45 80.61 Favored 'General case' 0 C--N 1.345 0.405 0 CA-C-N 119.11 0.868 . . . . 0.0 109.111 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.47 -50.61 72.49 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.526 0.603 . . . . 0.0 109.965 -175.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.39 -44.88 77.82 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.435 0.294 . . . . 0.0 111.781 176.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -51.35 -39.3 56.77 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.646 1.178 . . . . 0.0 111.444 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -65.9 -42.41 90.24 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.399 0.68 . . . . 0.0 111.258 -178.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.3 mp -61.95 -54.87 35.77 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 123.428 0.691 . . . . 0.0 109.977 175.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 13.6 t -55.67 -36.18 41.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 122.83 0.452 . . . . 0.0 111.131 178.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -65.69 -38.25 88.74 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.129 176.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -76.2 123.18 25.45 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 120.166 1.348 . . . . 0.0 109.515 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -67.77 -19.53 65.11 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 121.338 -0.851 . . . . 0.0 111.289 175.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.88 -11.23 84.09 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.801 1.191 . . . . 0.0 112.538 176.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.8 t -74.13 143.24 45.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 175.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -72.37 -14.58 61.75 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.475 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.6 t -86.19 136.59 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 126.825 2.05 . . . . 0.0 109.12 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.53 -27.36 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.436 1.094 . . . . 0.0 110.127 175.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -130.91 154.2 48.35 Favored 'General case' 0 C--N 1.343 0.318 0 CA-C-N 119.836 1.198 . . . . 0.0 111.261 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.7 t -139.33 160.94 28.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 128.32 2.648 . . . . 0.0 107.542 176.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 45.1 p -122.41 153.7 38.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 175.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -123.29 123.94 41.86 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 175.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -106.46 175.98 5.32 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 105.222 -2.14 . . . . 0.0 105.222 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -115.06 152.41 32.55 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 175.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -147.59 124.2 11.1 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 53.24 -84.51 0.01 OUTLIER Glycine 0 CA--C 1.53 1.02 0 C-N-CA 126.003 1.764 . . . . 0.0 114.857 176.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.8 p -136.07 25.25 3.29 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.988 1.315 . . . . 0.0 112.009 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -145.7 169.81 17.73 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 119.177 0.899 . . . . 0.0 112.229 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.3 mm -96.48 138.38 21.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 104.282 -2.488 . . . . 0.0 104.282 175.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.3 m -130.79 147.89 67.96 Favored Pre-proline 0 CA--C 1.531 0.25 0 C-N-CA 122.822 0.449 . . . . 0.0 110.947 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.73 139.99 34.79 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 121.566 1.511 . . . . 0.0 108.457 175.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -110.67 -147.65 11.31 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 125.506 1.527 . . . . 0.0 109.793 176.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -59.28 160.3 6.72 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 123.763 0.825 . . . . 0.0 111.179 175.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -141.28 166.06 25.82 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 126.137 1.775 . . . . 0.0 108.641 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.27 179.41 41.38 Favored Glycine 0 N--CA 1.452 -0.291 0 O-C-N 121.593 -0.692 . . . . 0.0 113.033 -175.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -124.14 -12.8 7.37 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 125.559 1.544 . . . . 0.0 113.476 -175.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -131.98 144.82 51.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -83.5 -9.04 59.22 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.429 0.691 . . . . 0.0 110.518 -174.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -58.31 -37.02 74.24 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.327 -1.483 . . . . 0.0 110.219 175.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 19.4 m80 -76.04 -29.34 58.03 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.261 1.024 . . . . 0.0 110.549 175.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -60.51 -32.87 71.87 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 121.565 -0.71 . . . . 0.0 111.994 178.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.5 mm -57.6 -35.62 51.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.4 mm-40 -71.87 -23.57 61.53 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.287 1.435 . . . . 0.0 112.345 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -65.03 -34.62 78.87 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 120.842 -1.161 . . . . 0.0 110.688 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.63 112.86 19.21 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 -176.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.3 p -113.82 172.53 6.92 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.753 1.621 . . . . 0.0 112.66 -175.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -46.38 -71.36 0.07 Allowed 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 118.267 2.691 . . . . 0.0 118.267 -174.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -106.58 -31.34 8.54 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -175.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.8 m -70.88 153.3 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.95 0 O-C-N 120.991 -1.068 . . . . 0.0 110.896 -175.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.87 148.16 26.47 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 175.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.3 tp -145.93 162.98 36.55 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.478 1.111 . . . . 0.0 109.495 -175.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -128.16 152.51 47.95 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.427 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.96 143.89 29.78 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 118.34 0.518 . . . . 0.0 112.137 176.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -109.88 123.73 50.1 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 176.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.5 t -133.02 138.99 50.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 122.72 0.408 . . . . 0.0 111.564 -175.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -79.95 120.5 24.24 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 104.187 -2.523 . . . . 0.0 104.187 175.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -135.92 164.2 28.49 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 86.0 m . . . . . 0 N--CA 1.45 -0.451 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 -176.234 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.9 m . . . . . 0 N--CA 1.448 -0.555 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.5 mmpm? -77.23 175.56 9.58 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 119.828 -1.795 . . . . 0.0 110.188 175.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -136.72 161.28 36.37 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.169 0.987 . . . . 0.0 108.712 -175.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.8 t -144.58 123.75 12.92 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 175.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mtpt -132.06 123.39 27.13 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 -175.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -86.06 129.39 34.86 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.088 -175.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -104.04 126.02 50.84 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -94.78 113.31 25.06 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 102.759 -3.052 . . . . 0.0 102.759 175.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.8 mp -95.13 143.53 11.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.2 m -125.42 123.22 38.8 Favored 'General case' 0 N--CA 1.435 -1.203 0 N-CA-C 102.66 -3.089 . . . . 0.0 102.66 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -99.67 124.52 44.98 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 104.039 -2.578 . . . . 0.0 104.039 175.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.2 mt -139.2 78.62 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -42.75 137.53 3.39 Favored Glycine 0 C--N 1.339 0.725 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -176.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -62.19 -4.07 1.58 Allowed 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 118.369 1.085 . . . . 0.0 112.485 -175.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -83.12 -35.98 25.17 Favored 'General case' 0 CA--C 1.521 -0.153 0 O-C-N 120.402 -1.437 . . . . 0.0 109.889 178.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.9 p -78.35 123.73 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 119.889 1.222 . . . . 0.0 109.084 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.3 t -146.05 123.63 11.78 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 175.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 133.26 -151.11 19.99 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 124.254 0.931 . . . . 0.0 111.084 -175.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -50.4 -38.5 43.23 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 126.193 1.797 . . . . 0.0 111.656 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -61.38 -38.11 85.83 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.169 1.35 . . . . 0.0 111.484 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.0 ttm180 -71.47 -37.29 71.34 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.751 1.16 . . . . 0.0 108.322 175.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.48 -31.57 72.77 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 118.788 -0.625 . . . . 0.0 111.849 178.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -59.51 -54.27 48.47 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 119.457 1.026 . . . . 0.0 108.394 176.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.8 m -52.16 -40.97 62.18 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.573 0.624 . . . . 0.0 110.367 175.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -58.77 -25.83 59.45 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-O 119.736 -0.48 . . . . 0.0 113.768 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 50.8 m -115.16 -0.29 13.33 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.568 1.184 . . . . 0.0 111.657 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -103.49 -23.14 13.54 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.71 1.604 . . . . 0.0 108.775 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.504 ' HZ2' ' CG2' ' A' ' 116' ' ' VAL . 87.4 mttt -53.33 -24.43 11.87 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 120.111 1.323 . . . . 0.0 110.437 174.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -64.09 -41.99 97.09 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.246 -0.909 . . . . 0.0 110.639 176.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 12.4 mt -62.82 -62.23 1.87 Allowed 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 125.363 1.465 . . . . 0.0 109.007 -176.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.257 0.9 OUTLIER -57.45 -31.32 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 117.501 -1.237 . . . . 0.0 110.702 176.353 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -60.92 -47.58 85.74 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 121.195 1.816 . . . . 0.0 109.8 175.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -54.37 -24.01 17.88 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.089 0.956 . . . . 0.0 111.539 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 61.5 t -86.15 -65.38 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.653 1.181 . . . . 0.0 108.036 175.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 98.1 t -64.8 25.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.814 1 C-N-CA 131.957 4.103 . . . . 0.0 113.747 -175.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -49.42 -26.6 3.39 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 115.553 1.686 . . . . 0.0 115.553 -175.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -105.49 84.44 2.09 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -138.13 176.52 8.63 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 124.787 1.235 . . . . 0.0 108.293 176.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -104.65 -62.38 1.34 Allowed 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.31 0.644 . . . . 0.0 109.869 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -156.45 175.79 13.55 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 127.554 2.342 . . . . 0.0 106.879 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -117.31 170.58 8.59 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 125.024 1.33 . . . . 0.0 111.077 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -141.67 150.54 42.03 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 105.187 -2.153 . . . . 0.0 105.187 -176.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.504 ' CG2' ' HZ2' ' A' ' 101' ' ' LYS . 65.2 t -124.27 128.7 73.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 175.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.4 mp -129.13 142.15 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 125.562 1.545 . . . . 0.0 107.182 -178.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.6 p -135.13 -3.26 2.48 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 175.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -130.85 149.7 52.36 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.094 1.758 . . . . 0.0 109.652 -175.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 14.0 ttp85 -69.46 -30.64 68.58 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.608 -0.71 . . . . 0.0 111.125 -176.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -73.47 -39.01 65.24 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 120.232 1.378 . . . . 0.0 109.095 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -63.86 -23.7 67.46 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.127 0.971 . . . . 0.0 110.35 175.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -71.93 -22.35 61.48 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.741 -1.224 . . . . 0.0 112.571 176.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -61.28 123.81 18.8 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -176.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -56.12 -31.59 63.45 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.232 1.013 . . . . 0.0 113.462 175.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -55.48 -43.28 75.39 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -175.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -94.9 -25.87 16.39 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 119.82 1.191 . . . . 0.0 109.473 176.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 14.9 mt -51.98 -39.7 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 124.782 1.233 . . . . 0.0 107.995 176.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -51.46 -52.29 47.7 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.764 0.711 . . . . 0.0 110.64 175.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -68.23 -40.62 81.99 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.38 0.536 . . . . 0.0 110.583 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -61.47 -39.21 90.06 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.315 -0.866 . . . . 0.0 111.263 178.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.4 mt -73.08 -40.42 65.03 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.767 1.227 . . . . 0.0 110.314 176.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -56.8 -44.54 82.04 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 175.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.75 -49.23 77.24 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.339 1.055 . . . . 0.0 109.208 175.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -177.959 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.396 0 N-CA-C 104.194 -2.521 . . . . 0.0 104.194 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.0 m -134.17 178.47 6.94 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.081 1.352 . . . . 0.0 108.328 -175.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.3 tttp -127.35 175.45 8.18 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.197 -0.94 . . . . 0.0 111.58 -175.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -139.97 148.2 23.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 C-N-CA 125.993 1.717 . . . . 0.0 107.851 175.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -91.57 79.47 5.48 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 103.478 -2.786 . . . . 0.0 103.478 175.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -60.64 -23.47 64.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 116.92 -1.514 . . . . 0.0 113.577 -175.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.33 -56.79 4.31 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.813 1.642 . . . . 0.0 109.309 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.43 89.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 119.727 -0.178 . . . . 0.0 111.473 -175.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 100.0 m -72.08 -33.85 68.22 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.474 -0.766 . . . . 0.0 111.082 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -24.89 66.52 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 117.856 -1.069 . . . . 0.0 110.704 176.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.68 -59.07 5.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 120.387 1.449 . . . . 0.0 110.146 176.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.34 -39.01 91.7 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.651 -0.656 . . . . 0.0 111.216 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -55.92 -47.11 78.08 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 118.438 -0.792 . . . . 0.0 109.532 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -54.67 -47.15 73.96 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 124.971 1.308 . . . . 0.0 110.351 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.3 mp -60.11 -53.97 51.48 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 118.465 0.575 . . . . 0.0 111.088 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 40.4 t -65.02 -24.28 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 O-C-N 121.19 -0.944 . . . . 0.0 111.352 -178.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -51.59 10.48 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 125.321 1.448 . . . . 0.0 110.719 176.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.68 123.71 21.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.693 0.679 . . . . 0.0 112.442 -175.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -67.84 -9.17 42.26 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.874 0.87 . . . . 0.0 113.101 -176.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -91.43 -0.57 72.96 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 119.438 1.017 . . . . 0.0 112.491 176.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.5 t -80.79 145.46 31.45 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 119.055 1.428 . . . . 0.0 111.029 178.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -80.47 -35.84 34.26 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.0 127.81 27.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 C-N-CA 125.669 1.587 . . . . 0.0 108.264 176.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -115.75 -23.87 3.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 125.002 1.321 . . . . 0.0 110.991 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -124.98 143.34 50.94 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.594 1.158 . . . . 0.0 108.836 -177.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.7 t -137.16 165.25 28.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 127.647 2.379 . . . . 0.0 109.44 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 82.8 p -132.9 156.33 47.42 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.725 1.21 . . . . 0.0 108.125 175.274 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -128.43 124.47 36.32 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 176.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -99.88 176.32 5.48 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -115.85 145.1 43.15 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 104.939 -2.245 . . . . 0.0 104.939 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -133.58 123.52 25.26 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.218 -2.512 . . . . 0.0 104.218 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 36.48 -96.96 0.01 OUTLIER Glycine 0 CA--C 1.533 1.167 0 C-N-CA 126.469 1.985 . . . . 0.0 113.22 -175.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 p -120.18 35.34 4.89 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.681 1.592 . . . . 0.0 113.197 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -146.49 168.74 20.45 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.31 1.044 . . . . 0.0 111.239 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.2 mm -100.14 138.49 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 175.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.7 m -134.08 161.43 63.79 Favored Pre-proline 0 N--CA 1.473 0.706 0 C-N-CA 123.587 0.755 . . . . 0.0 111.688 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.96 155.93 66.94 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 121.896 1.73 . . . . 0.0 108.469 175.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.02 -144.98 7.13 Favored Glycine 0 CA--C 1.52 0.388 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 176.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -68.97 159.64 32.37 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 175.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -141.11 161.84 36.91 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 125.552 1.541 . . . . 0.0 107.349 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.49 -178.21 46.93 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-O 122.393 0.996 . . . . 0.0 113.155 176.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.97 -26.43 4.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.002 1.321 . . . . 0.0 110.313 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -94.9 123.26 38.26 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -83.12 -14.27 53.95 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.201 0.6 . . . . 0.0 110.599 -176.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -57.74 -38.06 74.67 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.561 -1.337 . . . . 0.0 110.065 175.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -68.68 -32.31 72.04 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.645 -0.659 . . . . 0.0 111.575 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -57.98 -31.92 67.38 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.479 1.112 . . . . 0.0 111.025 178.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 mm -63.97 -47.65 89.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -67.78 -23.62 65.23 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.897 0.879 . . . . 0.0 112.799 176.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -67.8 -25.86 65.8 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 119.975 1.261 . . . . 0.0 111.644 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 74.3 m -73.79 112.89 10.34 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.384 0.611 . . . . 0.0 109.654 -175.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.37 2.1 p -105.23 167.28 9.83 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 127.298 2.239 . . . . 0.0 111.437 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -54.12 -76.68 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 -174.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -100.76 -28.25 12.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 119.685 1.129 . . . . 0.0 113.574 -174.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.0 m -58.77 137.71 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 O-C-N 121.276 -0.89 . . . . 0.0 109.619 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.11 134.9 47.45 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 105.09 -2.189 . . . . 0.0 105.09 175.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.8 tp -130.19 161.99 29.9 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 124.684 1.194 . . . . 0.0 109.801 -175.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -120.52 140.83 50.88 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 175.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.458 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -130.44 146.16 51.95 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 124.01 0.924 . . . . 0.0 108.856 176.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -123.74 123.62 40.91 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 103.562 -2.755 . . . . 0.0 103.562 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 t -138.07 146.61 26.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 118.917 0.781 . . . . 0.0 110.414 -175.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 20.2 ttm180 -79.69 123.99 28.16 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -128.82 170.75 12.99 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.917 1.287 . . . . 0.0 109.183 176.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 90.6 m . . . . . 0 N--CA 1.451 -0.391 0 C-N-CA 125.106 1.362 . . . . 0.0 107.864 -176.245 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -71.12 175.91 4.87 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 122.36 1.076 . . . . 0.0 108.937 175.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -132.52 150.21 52.19 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 175.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.1 t -125.12 128.92 49.18 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 103.511 -2.774 . . . . 0.0 103.511 175.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -136.08 123.91 22.6 Favored 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -177.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -91.6 128.11 37.3 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.589 -175.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -103.62 121.57 43.2 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 -176.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.79 113.37 23.39 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 105.048 -2.205 . . . . 0.0 105.048 175.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.0 mp -96.15 138.86 20.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 176.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -122.68 123.29 40.79 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 104.269 -2.493 . . . . 0.0 104.269 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 63.8 t-105 -92.13 123.33 35.4 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 104.224 -2.51 . . . . 0.0 104.224 175.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.0 mt -150.16 92.06 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 176.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -57.63 174.97 2.01 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 123.933 0.778 . . . . 0.0 113.183 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -86.51 -9.24 56.59 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.47 -1.018 . . . . 0.0 110.67 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -83.86 -31.74 25.61 Favored 'General case' 0 C--O 1.238 0.475 0 O-C-N 121.022 -1.049 . . . . 0.0 109.142 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -65.7 146.39 13.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 118.73 0.695 . . . . 0.0 110.739 -177.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 39.9 t -74.62 151.78 39.31 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 125.602 1.561 . . . . 0.0 110.812 -177.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.2 -28.87 69.82 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 123.907 0.765 . . . . 0.0 111.469 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.2 tt -62.39 -47.96 81.81 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 118.284 1.042 . . . . 0.0 109.653 176.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -65.46 -46.47 79.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.697 -0.668 . . . . 0.0 109.853 175.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.01 -27.9 61.99 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.45 1.023 . . . . 0.0 111.82 177.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.64 -36.68 85.03 Favored 'General case' 0 C--O 1.234 0.272 0 O-C-N 120.7 -1.25 . . . . 0.0 112.104 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -57.02 -46.42 82.37 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 118.641 -0.695 . . . . 0.0 109.515 176.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.2 m -55.38 -42.46 74.0 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 123.66 0.784 . . . . 0.0 109.781 -177.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -70.66 -26.35 74.21 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 119.195 0.907 . . . . 0.0 113.135 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 86.0 m -86.05 -15.95 39.67 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.768 1.227 . . . . 0.0 111.419 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -103.5 -23.73 13.49 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 127.458 2.303 . . . . 0.0 113.225 -175.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -50.0 -27.91 6.16 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.29 1.405 . . . . 0.0 113.004 176.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.2 t -62.88 -38.64 91.68 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.499 1.045 . . . . 0.0 112.072 176.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 12.4 mt -65.17 -61.33 2.2 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 125.419 1.488 . . . . 0.0 109.658 -176.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.257 0.8 OUTLIER -58.63 -28.96 38.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-O 118.117 -0.944 . . . . 0.0 109.262 175.636 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.01 -39.52 94.3 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 120.534 1.515 . . . . 0.0 109.653 175.503 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -54.52 -32.37 58.01 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 120.19 1.359 . . . . 0.0 112.988 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 52.5 t -86.44 -60.01 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 125.123 1.369 . . . . 0.0 111.022 176.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 3.5 t -74.32 26.62 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 129.193 2.997 . . . . 0.0 113.545 -175.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -53.61 -13.58 0.68 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 120.183 -1.573 . . . . 0.0 114.169 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -94.99 29.43 2.41 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.113 1.324 . . . . 0.0 113.08 175.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.37 174.12 9.32 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 175.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -123.69 -45.62 2.03 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.672 -0.642 . . . . 0.0 110.974 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.72 175.6 8.67 Favored 'General case' 0 C--O 1.235 0.29 1 C-N-CA 131.842 4.057 . . . . 0.0 106.333 175.811 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -132.1 171.4 13.68 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.82 0.848 . . . . 0.0 111.267 -178.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -146.85 149.98 34.35 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 40.3 t -123.62 124.22 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 175.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.7 mt -122.12 146.01 27.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 125.701 1.6 . . . . 0.0 109.521 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 12.8 p -140.08 -8.45 1.18 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.493 1.294 . . . . 0.0 114.493 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -137.41 154.4 49.97 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.743 1.156 . . . . 0.0 109.32 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 29.1 ttp-105 -50.6 -46.53 58.01 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 124.165 0.986 . . . . 0.0 110.733 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -63.45 -38.19 90.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 118.587 0.63 . . . . 0.0 110.295 -176.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -72.62 -23.92 61.0 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.81 1.244 . . . . 0.0 110.491 177.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -79.57 -23.72 42.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.923 1.689 . . . . 0.0 111.527 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -69.77 123.56 21.74 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.099 1.318 . . . . 0.0 110.543 -176.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.1 -13.87 14.03 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.813 1.245 . . . . 0.0 113.717 -178.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -56.09 -65.93 0.52 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.363 1.865 . . . . 0.0 112.802 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -77.34 -25.86 51.49 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 118.263 -1.375 . . . . 0.0 108.815 -175.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 19.5 mt -50.21 -41.17 18.46 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 C-N-CA 125.569 1.548 . . . . 0.0 108.444 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 33.4 mttp -55.95 -56.33 21.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.582 -0.723 . . . . 0.0 111.054 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 43.4 t -67.76 -33.27 74.53 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.613 1.097 . . . . 0.0 110.754 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -60.86 -52.79 63.56 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.583 1.083 . . . . 0.0 109.791 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.8 mt -59.87 -41.05 90.67 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 124.656 1.183 . . . . 0.0 111.125 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -62.55 -52.58 62.87 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 123.645 0.778 . . . . 0.0 110.804 176.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -61.61 -45.84 92.35 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 119.331 0.969 . . . . 0.0 109.182 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.444 0 C-N-CA 124.508 1.123 . . . . 0.0 111.693 175.602 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.216 0 CA-C-O 123.195 1.474 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.7 m -89.85 162.51 15.44 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 125.522 1.529 . . . . 0.0 107.868 176.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -133.45 -172.01 2.85 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 120.962 -1.086 . . . . 0.0 111.202 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.18 151.78 29.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 125.409 1.484 . . . . 0.0 108.964 175.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -86.7 79.0 9.0 Favored 'General case' 0 N--CA 1.464 0.272 1 N-CA-C 99.399 -4.297 . . . . 0.0 99.399 174.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.9 pttm -54.05 -35.4 61.97 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -74.49 -44.03 53.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 119.372 0.987 . . . . 0.0 109.469 -175.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.67 -45.86 73.99 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 118.13 0.423 . . . . 0.0 111.537 176.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 84.8 m -69.88 -41.6 74.56 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 119.382 -0.342 . . . . 0.0 110.574 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 -64.39 -32.29 73.85 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 116.631 -1.652 . . . . 0.0 109.777 175.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.87 -53.64 52.99 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 120.69 1.586 . . . . 0.0 110.029 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.23 -47.37 78.59 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.976 0.807 . . . . 0.0 110.98 176.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -55.54 -44.04 76.37 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.137 0.426 . . . . 0.0 111.005 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.54 -46.89 88.51 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 125.429 1.492 . . . . 0.0 109.612 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.2 mp -60.72 -46.57 89.88 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.789 0.722 . . . . 0.0 110.163 175.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.75 -39.38 81.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 123.598 0.759 . . . . 0.0 110.301 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -48.55 78.22 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -54.41 135.72 44.91 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 123.024 1.392 . . . . 0.0 113.032 -175.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -86.03 -22.69 27.12 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.679 1.992 . . . . 0.0 110.297 -178.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.35 -8.15 86.69 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.005 0.812 . . . . 0.0 112.947 176.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.7 t -81.21 139.62 35.41 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 118.653 1.226 . . . . 0.0 108.815 176.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -76.8 -35.65 57.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.311 0.644 . . . . 0.0 110.206 175.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.3 t -57.07 133.22 21.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 124.174 0.99 . . . . 0.0 108.935 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.09 -24.41 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 123.217 0.607 . . . . 0.0 109.656 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 49.3 p-90 -130.31 145.99 51.84 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 119.897 1.226 . . . . 0.0 110.366 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.9 t -137.28 168.42 21.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 175.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 76.5 p -132.02 161.01 34.23 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 175.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -135.19 123.9 23.77 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.76 -2.311 . . . . 0.0 104.76 -177.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -99.17 175.85 5.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 106.722 -1.585 . . . . 0.0 106.722 -176.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.448 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 24.0 m-85 -119.85 139.19 52.76 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 177.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -140.21 123.16 16.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 47.23 -98.47 0.01 OUTLIER Glycine 0 CA--C 1.526 0.768 0 C-N-CA 125.043 1.306 . . . . 0.0 113.818 -176.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 p -120.6 25.15 9.93 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.86 2.464 . . . . 0.0 111.745 -175.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -149.34 166.27 29.51 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.448 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 36.4 mm -92.88 133.1 35.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 175.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.7 m -126.7 160.95 55.97 Favored Pre-proline 0 N--CA 1.468 0.457 0 C-N-CA 123.406 0.682 . . . . 0.0 110.741 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.21 167.37 26.99 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 121.463 1.442 . . . . 0.0 109.11 175.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -139.23 -140.58 3.97 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.222 1.392 . . . . 0.0 112.13 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -66.86 156.42 35.73 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 126.749 2.02 . . . . 0.0 110.228 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -149.29 158.27 44.03 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 125.02 1.328 . . . . 0.0 110.14 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -173.39 174.68 46.12 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 123.91 0.767 . . . . 0.0 112.672 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.77 -8.9 7.85 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.72 1.608 . . . . 0.0 112.686 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.22 135.1 55.19 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 104.278 -2.49 . . . . 0.0 104.278 177.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.401 ' CE1' ' CD2' ' A' ' 51' ' ' PHE . 41.0 t80 -86.29 -14.67 43.0 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -175.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -55.28 -44.86 76.07 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.474 1.488 . . . . 0.0 109.532 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -62.68 -22.97 66.88 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.256 1.022 . . . . 0.0 112.028 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.401 ' CD2' ' CE1' ' A' ' 48' ' ' TYR . 0.7 OUTLIER -62.51 -55.54 26.53 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.766 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.02 -33.52 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.138 0.575 . . . . 0.0 109.815 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -62.49 -48.18 80.7 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -74.17 -22.43 59.42 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 -175.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 86.9 m -51.57 119.97 4.69 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 121.481 1.946 . . . . 0.0 110.727 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 p -101.54 164.18 11.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.458 1.503 . . . . 0.0 113.178 -175.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -49.77 -70.58 0.08 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 130.658 3.583 . . . . 0.0 119.251 -174.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -106.53 -36.49 6.75 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 124.845 1.258 . . . . 0.0 114.217 -175.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.6 m -58.39 145.36 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 CA-C-O 122.432 1.111 . . . . 0.0 110.397 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.72 139.64 38.69 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 175.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.4 tp -141.38 160.0 41.05 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -126.55 123.52 37.9 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 105.057 -2.201 . . . . 0.0 105.057 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -104.45 162.23 13.42 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 175.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -137.25 123.15 20.12 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 102.188 -3.264 . . . . 0.0 102.188 178.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.8 t -129.21 134.52 63.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -175.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 41.2 ttt85 -77.1 113.54 14.94 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 105.115 -2.18 . . . . 0.0 105.115 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -116.64 173.77 6.44 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 126.368 1.867 . . . . 0.0 108.963 -175.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 37.0 m . . . . . 0 C--N 1.327 -0.383 0 O-C-N 121.278 -0.889 . . . . 0.0 109.887 -176.013 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.8 m . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -69.26 167.05 17.14 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -138.44 167.9 20.91 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -177.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.3 t -125.58 158.37 34.8 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 175.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.5 mmmt -144.22 171.78 13.83 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 127.048 2.139 . . . . 0.0 107.475 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -144.53 123.88 13.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.532 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.94 129.24 56.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 126.054 1.742 . . . . 0.0 108.432 -176.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -98.57 113.8 25.99 Favored 'General case' 0 C--O 1.222 -0.342 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 175.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.1 mt -103.63 137.57 31.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 -177.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -116.05 122.89 46.51 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 175.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.0 t-105 -97.04 123.29 40.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 103.833 -2.654 . . . . 0.0 103.833 175.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.405 HD13 ' HE ' ' A' ' 94' ' ' ARG . 19.1 mt -145.56 98.12 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -59.94 162.86 16.18 Favored Glycine 0 CA--C 1.53 0.992 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -76.08 -6.41 51.0 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 121.07 -1.253 . . . . 0.0 110.998 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -83.2 -35.98 25.03 Favored 'General case' 0 C--N 1.341 0.231 0 O-C-N 121.423 -0.798 . . . . 0.0 109.589 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.7 p -71.56 127.62 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 176.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 48.3 t -63.32 153.44 34.94 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 124.28 1.032 . . . . 0.0 110.805 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -51.28 -29.94 23.71 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 125.678 1.608 . . . . 0.0 113.054 176.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.95 -51.66 69.11 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.355 1.078 . . . . 0.0 110.232 176.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -70.28 -31.49 68.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 118.51 -0.757 . . . . 0.0 110.036 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.405 ' HE ' HD13 ' A' ' 85' ' ' ILE . 6.7 ttt180 -63.41 -28.84 70.25 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.757 1.162 . . . . 0.0 109.273 175.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.89 -24.13 61.91 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.569 1.148 . . . . 0.0 111.958 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.36 -35.4 69.9 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 118.787 0.721 . . . . 0.0 110.481 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.7 m -54.8 -33.35 61.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.345 1.058 . . . . 0.0 110.146 175.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.33 -14.27 61.67 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 125.547 1.546 . . . . 0.0 114.481 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 30.0 m -123.18 -3.87 8.48 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.462 1.631 . . . . 0.0 109.894 175.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -103.79 -37.97 7.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 123.919 0.888 . . . . 0.0 112.684 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.5 mtmp? -57.18 -36.9 71.37 Favored 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 120.257 1.39 . . . . 0.0 111.376 -176.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -56.87 -34.06 67.46 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 120.255 1.388 . . . . 0.0 112.046 177.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 39.9 mt -66.21 -65.17 0.71 Allowed 'General case' 0 CA--C 1.508 -0.653 0 C-N-CA 125.887 1.675 . . . . 0.0 109.137 -176.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.1 p -57.73 -32.96 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-O 117.846 -1.073 . . . . 0.0 108.519 175.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -67.48 -24.31 65.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 121.144 1.793 . . . . 0.0 111.32 178.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.68 -27.22 66.66 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.92 1.236 . . . . 0.0 110.302 175.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 89.4 t -85.73 -56.68 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 175.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.1 t -70.09 17.35 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 130.17 3.388 . . . . 0.0 112.278 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -57.49 -26.71 61.7 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 119.406 -2.059 . . . . 0.0 111.027 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -94.9 72.35 3.48 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 125.247 1.419 . . . . 0.0 107.521 176.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -143.79 176.21 9.42 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.521 0.728 . . . . 0.0 110.209 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.68 -66.15 0.94 Allowed 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.772 0.829 . . . . 0.0 111.549 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -155.49 176.27 12.81 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.376 2.27 . . . . 0.0 111.778 -175.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -122.95 163.86 19.59 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.975 0.91 . . . . 0.0 111.212 175.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -138.67 147.75 43.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 -175.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.5 t -118.27 123.32 71.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 3.0 mt -132.44 143.27 40.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -176.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 7.7 p -143.24 -0.59 1.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.566 1.146 . . . . 0.0 112.679 -176.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -139.24 157.03 46.63 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.053 1.741 . . . . 0.0 108.846 -175.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -73.54 -41.67 62.68 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.823 -176.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -62.55 -34.37 76.81 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 120.136 1.335 . . . . 0.0 109.429 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -65.48 -23.3 66.87 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.785 1.634 . . . . 0.0 110.768 175.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -86.44 -23.53 26.0 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.657 1.183 . . . . 0.0 113.888 -176.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -57.15 123.84 16.67 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.711 1.204 . . . . 0.0 110.753 -176.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.97 -23.82 66.63 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.518 ' HA ' ' CE ' ' A' ' 129' ' ' LYS 0.356 10.5 t70 -57.69 -52.16 66.59 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 121.454 1.934 . . . . 0.0 113.526 -175.437 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -74.35 -23.15 58.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 116.821 -1.952 . . . . 0.0 109.019 -177.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 56.6 mt -55.78 -41.8 67.43 Favored 'Isoleucine or valine' 0 C--N 1.347 0.473 0 CA-C-N 119.283 0.947 . . . . 0.0 108.519 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.518 ' CE ' ' HA ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -54.73 -51.23 66.29 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 119.91 1.232 . . . . 0.0 111.434 175.588 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.9 t -71.25 -31.39 67.48 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.058 -175.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 36.1 tp10 -63.93 -46.51 84.46 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.612 1.165 . . . . 0.0 108.798 175.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 91.2 mt -66.18 -31.01 71.59 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.555 -0.716 . . . . 0.0 110.412 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? -65.98 -49.13 68.92 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.488 1.04 . . . . 0.0 108.317 175.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 39.9 mtmt -56.46 -45.06 81.04 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.824 0.738 . . . . 0.0 110.117 176.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 125.358 1.463 . . . . 0.0 114.029 176.607 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.16 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.2 m -143.05 166.44 24.63 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.065 1.746 . . . . 0.0 106.805 -175.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.5 tttm -130.14 -178.66 4.83 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 124.137 0.975 . . . . 0.0 109.799 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.56 147.81 28.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 176.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -89.91 73.06 7.47 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 175.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -31.6 69.84 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-O 118.108 -0.949 . . . . 0.0 109.649 -176.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -63.74 -56.85 12.48 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.26 0.936 . . . . 0.0 109.394 -177.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.18 -43.27 82.6 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 122.27 -0.268 . . . . 0.0 110.846 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 79.9 m -68.91 -28.14 66.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.436 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -61.5 -38.86 88.86 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.527 176.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.44 -56.3 23.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 119.358 0.981 . . . . 0.0 109.771 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.06 -42.93 99.42 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.862 -0.524 . . . . 0.0 111.268 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.471 ' HH ' ' ND2' ' A' ' 110' ' ' ASN . 4.5 t80 -53.34 -48.48 68.45 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 175.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -61.56 -47.01 87.45 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 124.93 1.292 . . . . 0.0 110.348 -176.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -63.74 -27.39 69.17 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.6 t -83.53 -33.27 9.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 118.889 0.768 . . . . 0.0 109.948 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -70.56 -44.69 66.89 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.493 1.917 . . . . 0.0 111.743 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -70.83 123.49 22.1 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.646 1.578 . . . . 0.0 113.162 -175.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -72.21 -11.83 60.9 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.705 0.802 . . . . 0.0 110.217 175.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.74 -26.6 62.47 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 125.514 1.531 . . . . 0.0 111.705 175.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.2 t -85.92 150.24 24.64 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.915 1.686 . . . . 0.0 108.709 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.93 -14.58 44.3 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.215 0.606 . . . . 0.0 111.723 175.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.6 t -70.53 133.54 31.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -176.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.31 -24.06 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 118.456 -0.783 . . . . 0.0 111.44 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 55.0 p-90 -131.61 153.15 50.22 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 120.014 1.279 . . . . 0.0 110.83 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.7 t -140.86 164.37 21.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 129.663 3.185 . . . . 0.0 109.122 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 39.2 p -128.82 158.56 38.36 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.366 1.466 . . . . 0.0 107.883 175.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -133.56 123.69 25.58 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.5 mtpt -99.63 176.9 5.32 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 175.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -117.53 144.13 45.39 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 175.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -142.83 156.47 44.95 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 175.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 35.92 -104.7 0.03 OUTLIER Glycine 0 CA--C 1.53 0.992 0 C-N-CA 125.742 1.639 . . . . 0.0 112.065 -175.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.6 p -129.89 41.96 3.35 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 127.443 2.297 . . . . 0.0 109.456 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.9 t -149.55 172.73 14.54 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.113 0.965 . . . . 0.0 112.349 -175.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.5 mm -99.62 140.03 19.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 175.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.7 m -129.85 156.57 78.76 Favored Pre-proline 0 N--CA 1.469 0.514 0 C-N-CA 123.436 0.694 . . . . 0.0 110.551 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -71.46 154.35 60.57 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.812 1.674 . . . . 0.0 109.98 175.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -126.28 -158.21 9.82 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 125.738 1.637 . . . . 0.0 109.703 176.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -53.17 157.55 1.83 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 126.607 1.963 . . . . 0.0 111.468 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.2 pm0 -144.57 169.86 17.17 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.269 1.428 . . . . 0.0 109.885 177.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -172.61 166.47 39.16 Favored Glycine 0 CA--C 1.522 0.48 0 CA-C-O 122.222 0.901 . . . . 0.0 112.76 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -99.23 -18.51 17.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.239 1.416 . . . . 0.0 110.548 175.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -129.2 139.02 52.03 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 176.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.419 ' CE1' ' CD2' ' A' ' 51' ' ' PHE . 53.8 t80 -83.82 -5.18 59.15 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.633 1.973 . . . . 0.0 113.077 -175.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -57.72 -36.85 72.58 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 120.62 -1.3 . . . . 0.0 110.958 176.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -65.77 -39.9 91.49 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.943 0.897 . . . . 0.0 110.504 176.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.419 ' CD2' ' CE1' ' A' ' 48' ' ' TYR . 33.2 t80 -56.97 -34.94 68.57 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 125.223 1.409 . . . . 0.0 112.029 -176.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 mm -60.03 -35.75 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 24.8 mm100 -85.86 -24.15 26.81 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.429 1.492 . . . . 0.0 112.457 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -67.48 -24.66 65.62 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 118.942 0.792 . . . . 0.0 111.467 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 78.0 m -75.21 113.42 12.54 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.311 2.1 p -92.89 171.23 9.1 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.595 1.558 . . . . 0.0 112.667 -175.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.445 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 2.7 p-10 -47.21 -74.65 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 118.118 2.636 . . . . 0.0 118.118 -174.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.445 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 1.8 t70 -107.51 -35.62 6.7 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 127.323 2.249 . . . . 0.0 115.965 -174.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.4 m -54.93 155.53 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 N-CA-C 114.714 1.376 . . . . 0.0 114.714 -175.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 26.7 ptt-85 -103.99 135.32 45.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.6 tp -142.74 165.71 26.64 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 125.989 1.716 . . . . 0.0 107.249 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -131.41 154.55 48.53 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -136.45 151.97 50.07 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 123.581 0.752 . . . . 0.0 111.222 176.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -123.46 123.57 40.95 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 104.191 -2.522 . . . . 0.0 104.191 175.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.9 t -130.36 139.27 51.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 122.866 0.467 . . . . 0.0 109.879 -175.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -86.8 126.61 34.73 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 106.179 -1.785 . . . . 0.0 106.179 175.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -136.11 168.36 19.52 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -175.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.327 -0.398 0 O-C-N 120.717 -1.239 . . . . 0.0 108.066 175.779 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.445 -0.68 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -67.13 165.45 15.92 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -133.31 153.96 51.12 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 105.667 -1.975 . . . . 0.0 105.667 175.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 t -129.59 123.93 32.53 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 176.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 49.5 mttt -132.49 145.54 51.25 Favored 'General case' 0 CA--C 1.503 -0.864 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -114.65 144.68 43.04 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.439 -0.8 . . . . 0.0 108.981 -175.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -116.24 121.22 41.4 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 -178.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -91.02 113.36 25.6 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 102.251 -3.24 . . . . 0.0 102.251 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -103.05 143.93 14.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -122.43 123.53 41.53 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 104.737 -2.32 . . . . 0.0 104.737 175.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.8 t-105 -100.78 124.03 45.83 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 104.033 -2.58 . . . . 0.0 104.033 175.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.2 mm -127.12 98.62 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 175.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -44.22 126.85 6.38 Favored Glycine 0 C--N 1.342 0.867 0 N-CA-C 107.008 -2.437 . . . . 0.0 107.008 176.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -54.5 -7.64 0.17 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 -175.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -83.56 -35.87 24.41 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.755 1.622 . . . . 0.0 112.454 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.4 p -75.07 135.75 26.58 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 CA-C-N 121.029 1.74 . . . . 0.0 111.62 -175.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.0 t -146.4 176.7 9.59 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.821 1.248 . . . . 0.0 108.909 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 81.05 -142.58 23.37 Favored Glycine 0 CA--C 1.521 0.443 0 O-C-N 121.654 -0.654 . . . . 0.0 113.062 175.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 9.2 tt -53.18 -44.66 68.09 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 124.791 1.237 . . . . 0.0 110.578 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -60.83 -35.55 76.82 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.115 0.566 . . . . 0.0 110.953 -177.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.8 ttt-85 -70.7 -44.56 66.7 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.209 -0.932 . . . . 0.0 108.542 175.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.69 68.87 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.184 0.594 . . . . 0.0 112.444 177.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -58.62 -54.71 44.0 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 175.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.0 m -51.7 -45.67 63.59 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 119.513 1.051 . . . . 0.0 109.974 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -60.4 -25.88 63.43 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-O 119.91 -0.383 . . . . 0.0 113.729 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.8 m -101.4 -9.83 20.77 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.058 1.743 . . . . 0.0 111.232 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -103.84 -23.81 13.36 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 126.134 1.773 . . . . 0.0 112.462 -175.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 42.1 mtpt -54.25 -31.84 54.53 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.466 1.484 . . . . 0.0 112.035 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 5.4 t -66.84 -29.4 69.31 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.288 0.949 . . . . 0.0 112.226 175.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 10.7 mt -68.21 -63.55 1.04 Allowed 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 125.169 1.388 . . . . 0.0 108.758 -176.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.36 -29.02 41.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 118.04 -0.981 . . . . 0.0 108.741 175.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.6 tttp -65.82 -27.34 68.18 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 120.87 1.668 . . . . 0.0 110.72 175.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -65.02 -27.51 68.86 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 121.224 1.829 . . . . 0.0 111.107 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 72.8 t -85.71 -48.87 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 175.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 65.6 t -84.46 26.07 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 128.796 2.838 . . . . 0.0 111.15 -175.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -56.93 -26.32 59.23 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 121.246 1.839 . . . . 0.0 110.942 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.471 ' ND2' ' HH ' ' A' ' 17' ' ' TYR . 3.1 t30 -90.08 80.66 6.3 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.954 1.702 . . . . 0.0 106.867 175.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -148.6 176.31 10.44 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 175.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.42 -64.69 1.26 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.899 0.88 . . . . 0.0 111.789 -175.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -132.03 172.32 12.51 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.353 1.461 . . . . 0.0 110.366 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -125.89 164.54 20.52 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.757 1.223 . . . . 0.0 108.234 175.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -150.96 146.07 26.01 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 103.831 -2.655 . . . . 0.0 103.831 -175.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.7 t -122.98 123.82 68.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 3.3 mt -129.41 150.82 34.99 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 125.459 1.504 . . . . 0.0 108.76 -175.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.0 p -151.27 0.34 0.38 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.34 1.056 . . . . 0.0 113.804 177.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.452 ' OD1' ' HE2' ' A' ' 121' ' ' LYS . 5.0 t70 -126.03 145.87 50.13 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.15 1.38 . . . . 0.0 108.906 -175.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 45.4 ttt85 -65.46 -33.93 77.08 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.452 ' HE2' ' OD1' ' A' ' 119' ' ' ASP . 7.4 mtmm -68.78 -45.64 70.8 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 120.125 1.33 . . . . 0.0 108.169 175.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.02 -23.77 62.25 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.466 1.907 . . . . 0.0 111.596 -179.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -78.16 -22.85 48.09 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.571 1.948 . . . . 0.0 113.782 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -69.99 129.84 40.57 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.562 1.528 . . . . 0.0 113.592 -176.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -57.92 -25.79 61.35 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.082 1.353 . . . . 0.0 113.715 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -53.61 -55.04 29.24 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 123.869 0.868 . . . . 0.0 112.495 -176.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -86.37 -23.86 26.02 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 118.517 -1.273 . . . . 0.0 109.029 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 64.4 mt -55.06 -40.13 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 175.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -52.14 -54.27 32.66 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.977 0.808 . . . . 0.0 110.012 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.2 t -69.0 -36.03 77.36 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.957 -0.544 . . . . 0.0 111.27 -177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -64.3 -39.46 93.97 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.991 1.269 . . . . 0.0 110.054 176.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 67.5 mt -69.78 -30.52 68.1 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 120.94 -1.1 . . . . 0.0 110.1 175.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 8.0 mtmp? -67.25 -45.94 75.22 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -57.21 -55.78 30.27 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 124.407 1.083 . . . . 0.0 111.811 179.305 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.452 0 CA-C-O 122.023 0.916 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.0 m -121.99 176.1 5.97 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.215 1.806 . . . . 0.0 106.575 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -137.86 -179.22 5.64 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.733 -1.23 . . . . 0.0 113.584 -175.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.23 148.6 32.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 C-N-CA 124.522 1.129 . . . . 0.0 108.891 175.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -94.43 76.73 3.88 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 102.455 -3.165 . . . . 0.0 102.455 175.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.6 ttpt -60.26 -27.22 67.06 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 118.047 -0.978 . . . . 0.0 112.812 -175.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -69.35 -57.96 4.62 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 119.588 1.085 . . . . 0.0 109.927 176.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.96 -40.58 83.18 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.758 0.708 . . . . 0.0 110.982 -178.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.6 m -67.68 -29.84 69.21 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 121.369 -0.832 . . . . 0.0 111.4 -178.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.7 ttt85 -60.65 -33.18 72.43 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-O 117.418 -1.277 . . . . 0.0 109.508 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.63 -51.48 69.23 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 120.126 1.33 . . . . 0.0 110.118 -179.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.71 76.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 121.913 -0.492 . . . . 0.0 110.835 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -56.27 -38.92 71.82 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.051 0.54 . . . . 0.0 111.196 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -62.93 -55.88 22.04 Favored 'General case' 0 CA--C 1.522 -0.126 0 C-N-CA 124.854 1.262 . . . . 0.0 110.046 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mp -59.84 -32.17 70.43 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 81.6 t -75.62 -34.55 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-N 118.487 0.585 . . . . 0.0 109.528 176.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -72.33 -42.72 65.07 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 119.271 0.942 . . . . 0.0 111.239 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.64 136.64 57.19 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 126.408 1.883 . . . . 0.0 114.022 -175.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.408 ' CG ' HH22 ' A' ' 66' ' ' ARG . 0.8 OUTLIER -86.27 -21.91 27.1 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.539 1.536 . . . . 0.0 113.049 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.24 -33.07 36.86 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 108.789 -1.725 . . . . 0.0 108.789 175.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 t -66.4 123.72 20.77 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 175.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -78.04 -6.76 55.58 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.144 0.578 . . . . 0.0 111.442 175.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.6 t -70.17 127.42 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 175.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.04 -23.82 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 CA-C-O 118.376 -0.821 . . . . 0.0 109.716 175.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 38.6 p-90 -130.71 140.46 50.35 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.737 1.153 . . . . 0.0 110.701 178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 35.0 t -139.59 152.3 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 175.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 37.2 p -103.56 158.8 16.11 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -127.91 123.97 36.24 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -110.63 176.33 5.08 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -176.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -119.54 140.66 50.17 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 177.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -141.01 136.02 31.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 55.59 -96.35 0.04 OUTLIER Glycine 0 CA--C 1.531 1.045 0 CA-C-N 119.001 0.819 . . . . 0.0 111.654 -178.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.2 p -136.26 28.74 3.08 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.31 1.844 . . . . 0.0 111.333 175.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.8 t -143.92 163.66 32.81 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 -175.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.2 mm -83.67 138.94 18.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.0 m -134.26 159.43 72.33 Favored Pre-proline 0 C--N 1.329 -0.309 0 C-N-CA 124.765 1.226 . . . . 0.0 109.534 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.42 162.08 36.57 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 CA-C-N 120.801 1.322 . . . . 0.0 108.887 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -127.61 -165.0 11.78 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 126.263 1.887 . . . . 0.0 109.832 175.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -56.06 159.27 3.43 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.723 1.209 . . . . 0.0 110.914 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -145.2 168.21 20.94 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.184 1.394 . . . . 0.0 111.843 -175.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.1 -174.62 43.69 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 122.23 0.906 . . . . 0.0 112.328 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.41 -21.06 7.61 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.998 1.719 . . . . 0.0 110.992 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -106.24 117.36 33.83 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.571 1.148 . . . . 0.0 108.695 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -82.79 -16.09 49.17 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.24 0.616 . . . . 0.0 110.151 -177.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -62.57 -27.28 69.07 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 119.545 -1.972 . . . . 0.0 109.964 175.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -76.07 -31.4 58.75 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.74 1.216 . . . . 0.0 111.05 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -57.51 -35.97 70.94 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 125.009 1.323 . . . . 0.0 110.383 178.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.7 mm -58.58 -33.68 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 -176.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -77.78 -24.02 49.0 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.485 1.114 . . . . 0.0 112.213 177.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -72.3 -24.09 61.27 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 119.804 1.184 . . . . 0.0 112.091 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.5 m -65.97 132.97 49.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.772 0.715 . . . . 0.0 109.763 -177.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.856 ' HG1' ' CG2' ' A' ' 59' ' ' VAL 0.256 2.1 p -112.95 163.5 14.59 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.696 1.998 . . . . 0.0 110.622 -176.833 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -50.05 -76.38 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 130.224 3.41 . . . . 0.0 117.314 -175.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -102.67 -36.09 8.45 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 123.669 0.788 . . . . 0.0 112.667 -175.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.856 ' CG2' ' HG1' ' A' ' 56' ' ' THR . 17.4 m -56.73 147.98 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 CA-C-O 122.264 1.03 . . . . 0.0 112.078 -175.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.58 136.42 43.34 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 41.4 tp -138.19 167.81 21.05 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.918 1.287 . . . . 0.0 108.088 -176.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -132.39 146.97 52.35 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.427 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -144.45 124.49 13.59 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 118.39 0.541 . . . . 0.0 109.87 175.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -90.31 123.67 34.27 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 175.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.3 t -133.96 140.86 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 121.397 0.617 . . . . 0.0 109.764 -175.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.408 HH22 ' CG ' ' A' ' 23' ' ' ASP . 48.7 ttt180 -84.73 139.0 32.3 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.37 1.468 . . . . 0.0 108.667 175.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -136.2 150.24 48.91 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.159 1.384 . . . . 0.0 108.508 -176.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 99.3 m . . . . . 0 C--N 1.33 -0.268 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.324 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.3 m . . . . . 0 CA--C 1.536 0.417 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -63.3 163.59 10.28 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.852 0.834 . . . . 0.0 109.662 175.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.4 mmt85 -128.29 167.72 16.52 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 126.25 1.82 . . . . 0.0 108.096 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.3 t -133.24 142.48 48.56 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.0 mmtp -141.5 172.15 13.08 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 125.939 1.696 . . . . 0.0 108.002 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -145.55 130.03 17.85 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -177.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.83 119.02 33.61 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.69 113.24 21.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 103.295 -2.854 . . . . 0.0 103.295 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -85.28 132.89 30.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 176.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -116.46 123.28 47.11 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 101.873 -3.38 . . . . 0.0 101.873 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.1 t-105 -102.29 126.87 49.41 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 106.325 -1.732 . . . . 0.0 106.325 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.5 mt -138.48 102.0 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 N-CA-C 104.471 -2.418 . . . . 0.0 104.471 175.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.91 125.13 37.87 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 105.992 -2.843 . . . . 0.0 105.992 175.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -55.68 -3.88 0.09 Allowed 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 119.95 1.875 . . . . 0.0 115.003 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 -82.97 -31.35 27.64 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 120.596 -1.315 . . . . 0.0 109.723 177.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.9 p -69.58 136.66 25.75 Favored 'Isoleucine or valine' 0 C--N 1.343 0.31 0 CA-C-N 120.306 1.412 . . . . 0.0 109.588 176.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.3 t -144.04 177.01 8.87 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.306 1.442 . . . . 0.0 108.702 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.02 -145.3 49.63 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 176.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.68 -42.32 78.84 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 124.557 1.143 . . . . 0.0 110.901 -176.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -59.83 -43.42 94.57 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 119.215 0.916 . . . . 0.0 110.06 -176.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -69.64 -44.21 71.07 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.425 -0.797 . . . . 0.0 109.069 175.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.58 -23.47 50.95 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.144 0.978 . . . . 0.0 112.548 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -51.24 -53.82 31.68 Favored 'General case' 0 CA--C 1.504 -0.808 0 CA-C-N 119.772 1.169 . . . . 0.0 108.356 175.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.3 m -57.05 -41.04 77.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.737 0.699 . . . . 0.0 111.558 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.78 -18.78 64.51 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-N 118.161 0.437 . . . . 0.0 112.843 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.6 m -103.41 -17.74 15.12 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.416 1.086 . . . . 0.0 111.677 176.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -103.05 -23.99 13.65 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 117.755 2.502 . . . . 0.0 117.755 -174.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.2 mtmt -50.12 -28.01 6.61 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 122.212 2.278 . . . . 0.0 114.089 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.5 t -62.92 -35.5 80.3 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.119 1.327 . . . . 0.0 111.657 176.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 22.6 mt -61.73 -64.54 0.91 Allowed 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 126.554 1.942 . . . . 0.0 109.054 -176.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.92 -32.73 40.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.343 175.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -26.34 64.89 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 120.748 1.613 . . . . 0.0 111.793 175.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -64.38 -28.19 69.53 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 120.719 -1.238 . . . . 0.0 110.165 175.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 95.5 t -86.6 -65.59 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 125.338 1.455 . . . . 0.0 108.294 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 19.9 t -67.58 27.4 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.882 1 C-N-CA 132.97 4.508 . . . . 0.0 113.464 -175.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -52.63 -26.15 12.81 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.184 -1.573 . . . . 0.0 114.309 -175.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -104.83 95.22 5.73 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -150.66 163.33 38.78 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.298 1.039 . . . . 0.0 108.95 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.81 -66.69 0.58 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.83 163.46 5.01 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 131.493 3.917 . . . . 0.0 105.836 175.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -85.6 173.16 10.36 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 122.521 0.328 . . . . 0.0 111.018 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -129.59 157.45 42.05 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.5 t -116.95 123.81 72.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 175.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mt -132.06 126.71 56.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . 0.382 2.8 p -126.6 1.22 6.85 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 115.848 1.796 . . . . 0.0 115.848 175.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -146.17 158.03 43.86 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.802 0.841 . . . . 0.0 110.358 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -55.49 -42.25 74.14 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.836 175.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.42 -27.56 67.58 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 120.561 1.528 . . . . 0.0 112.612 178.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -83.37 -23.97 32.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.518 1.127 . . . . 0.0 110.751 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -75.56 -23.79 56.59 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.014 2.126 . . . . 0.0 113.091 -178.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -68.8 123.18 20.24 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -175.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -50.69 -32.12 18.41 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 115.973 1.842 . . . . 0.0 115.973 175.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -56.3 -32.31 64.48 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -108.03 -21.54 12.77 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.45 1.023 . . . . 0.0 108.589 175.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 46.8 mt -56.15 -36.97 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -58.73 -53.67 55.71 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.771 -0.581 . . . . 0.0 110.345 176.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 9.1 t -64.65 -31.79 73.17 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.135 0.879 . . . . 0.0 111.89 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -65.29 -52.89 51.19 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 124.997 1.319 . . . . 0.0 109.146 176.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 47.3 mt -60.88 -34.72 75.05 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.499 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -62.13 -52.98 61.67 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.194 0.906 . . . . 0.0 108.846 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 26.5 mmtt -54.28 -52.58 60.99 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.413 0.685 . . . . 0.0 110.928 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.278 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -175.979 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.34 0 CA-C-O 121.561 0.696 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.4 m -110.38 170.74 7.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.335 1.854 . . . . 0.0 106.07 175.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -125.09 172.71 9.25 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.778 -1.201 . . . . 0.0 110.819 -176.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.68 153.4 17.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 C-N-CA 124.582 1.153 . . . . 0.0 109.29 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -94.6 73.37 3.71 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 102.69 -3.078 . . . . 0.0 102.69 175.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 31.4 pttt -58.88 -27.84 65.57 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 117.454 -1.26 . . . . 0.0 111.448 -175.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.2 -56.39 5.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.191 0.997 . . . . 0.0 110.068 -175.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.78 -35.45 77.07 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 121.2 -0.2 . . . . 0.0 110.684 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.0 m -69.46 -34.21 74.05 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 118.534 -0.746 . . . . 0.0 110.363 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 76.0 ttt-85 -60.09 -39.63 86.82 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.846 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.62 -59.0 5.31 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 123.878 0.737 . . . . 0.0 109.489 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.14 -36.7 84.89 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.873 -0.517 . . . . 0.0 112.121 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -62.2 -28.77 69.91 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.181 0.992 . . . . 0.0 111.207 175.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -74.89 -46.37 36.49 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 124.264 1.025 . . . . 0.0 109.376 175.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.5 mp -57.13 -56.39 22.35 Favored 'General case' 0 C--O 1.221 -0.396 0 O-C-N 121.586 -0.696 . . . . 0.0 110.627 175.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.9 t -59.45 -29.08 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 118.494 0.588 . . . . 0.0 111.13 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -69.94 -45.43 67.49 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 119.992 1.269 . . . . 0.0 111.224 175.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -63.36 123.65 19.25 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.994 1.718 . . . . 0.0 111.311 -175.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -64.81 -27.85 69.16 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.975 1.31 . . . . 0.0 111.992 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.15 -11.31 76.27 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 124.4 1.0 . . . . 0.0 112.669 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -62.08 128.75 37.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 119.046 1.423 . . . . 0.0 108.461 176.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.26 -35.78 82.1 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.8 t -72.5 126.26 32.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 125.42 1.488 . . . . 0.0 108.23 175.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.3 pp -113.72 -23.68 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 124.967 1.307 . . . . 0.0 111.062 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -128.08 145.63 50.94 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.784 0.72 . . . . 0.0 109.975 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.5 t -135.83 161.82 37.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 126.482 1.913 . . . . 0.0 107.636 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.441 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 14.2 p -119.54 159.26 24.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.377 1.071 . . . . 0.0 108.939 175.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -137.09 127.8 27.11 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.378 1.471 . . . . 0.0 107.254 -177.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -113.74 176.75 4.9 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 127.074 2.15 . . . . 0.0 107.805 -178.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -118.91 138.22 52.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 175.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -137.48 132.43 33.3 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 59.12 -107.43 1.2 Allowed Glycine 0 CA--C 1.529 0.945 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -175.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.1 p -130.09 29.84 4.87 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.899 1.279 . . . . 0.0 111.704 175.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -130.37 169.1 15.91 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.635 0.652 . . . . 0.0 110.215 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 38.5 mm -94.98 138.33 21.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 104.21 -2.515 . . . . 0.0 104.21 175.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.3 m -130.81 154.32 81.86 Favored Pre-proline 0 C--N 1.329 -0.309 0 C-N-CA 124.067 0.947 . . . . 0.0 110.326 176.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -75.81 159.66 38.21 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 C-N-CA 121.986 1.791 . . . . 0.0 109.386 175.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -130.62 -162.77 10.8 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 127.201 2.334 . . . . 0.0 108.965 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -58.93 166.92 1.78 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 126.2 1.8 . . . . 0.0 111.723 -176.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.74 171.31 16.44 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 124.749 1.219 . . . . 0.0 111.127 -175.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -171.97 -178.06 41.98 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 123.763 0.697 . . . . 0.0 111.891 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.3 -26.69 7.08 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.871 1.268 . . . . 0.0 111.378 176.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -105.81 130.26 53.82 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 105.672 -1.973 . . . . 0.0 105.672 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.419 ' CE2' ' CD2' ' A' ' 51' ' ' PHE . 21.6 t80 -82.84 -9.47 59.31 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.511 0.724 . . . . 0.0 110.413 -175.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -54.22 -33.73 59.0 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.329 -1.482 . . . . 0.0 110.607 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.4 m80 -68.27 -25.04 64.97 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.305 1.442 . . . . 0.0 112.772 176.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . 0.419 ' CD2' ' CE2' ' A' ' 48' ' ' TYR . 0.6 OUTLIER -62.84 -52.41 63.24 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.158 -0.964 . . . . 0.0 108.842 178.393 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.41 -40.31 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -178.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -61.23 -32.81 72.59 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.172 0.989 . . . . 0.0 112.362 175.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -81.27 -23.59 37.86 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 117.857 -1.068 . . . . 0.0 113.563 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 92.4 m -53.62 114.35 1.5 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 120.183 1.356 . . . . 0.0 111.756 -175.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.427 ' HG1' ' CG2' ' A' ' 59' ' ' VAL 0.25 2.0 p -83.91 164.8 19.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.91 2.084 . . . . 0.0 112.153 -178.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.46 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 6.8 p-10 -55.34 -77.12 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 131.153 3.781 . . . . 0.0 120.645 -175.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.46 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 12.6 t70 -106.56 -20.79 13.26 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 127.042 2.137 . . . . 0.0 114.673 -174.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.427 ' CG2' ' HG1' ' A' ' 56' ' ' THR . 3.0 m -68.11 168.67 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-O 122.484 1.135 . . . . 0.0 113.388 -175.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.75 123.37 42.51 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 103.109 -2.923 . . . . 0.0 103.109 175.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 42.7 tp -130.65 168.12 17.66 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.864 2.066 . . . . 0.0 109.072 -175.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -132.5 155.45 48.55 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 123.547 0.739 . . . . 0.0 109.679 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.441 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -146.23 137.25 24.41 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.272 0.629 . . . . 0.0 110.86 176.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -104.91 123.83 48.42 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 105.864 -1.902 . . . . 0.0 105.864 175.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.7 t -133.11 136.52 55.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 -175.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.3 ttp-105 -80.83 134.44 35.78 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -136.1 159.75 40.75 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.835 0.854 . . . . 0.0 108.97 -175.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.7 m . . . . . 0 N--CA 1.454 -0.258 0 O-C-N 120.612 -1.305 . . . . 0.0 109.137 -177.25 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.0 m . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -62.99 157.47 21.81 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -122.15 162.66 20.9 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 -176.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.2 t -138.87 142.13 38.6 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 106.255 -1.757 . . . . 0.0 106.255 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -143.8 173.97 11.22 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 127.271 2.228 . . . . 0.0 106.525 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -146.35 139.04 25.37 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.83 121.39 43.85 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 175.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.96 113.35 25.59 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 101.52 -3.511 . . . . 0.0 101.52 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mp -94.31 144.37 9.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 -178.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -124.05 123.45 40.38 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 103.186 -2.894 . . . . 0.0 103.186 175.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -100.11 128.63 46.16 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 105.129 -2.174 . . . . 0.0 105.129 175.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.0 mt -131.84 103.64 7.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 102.723 -3.065 . . . . 0.0 102.723 175.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.432 ' C ' ' H ' ' A' ' 88' ' ' ASN . . . -55.42 122.84 28.03 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 106.8 -2.52 . . . . 0.0 106.8 175.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -55.0 -3.61 0.05 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.561 1.544 . . . . 0.0 114.154 -175.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 86' ' ' GLY . 53.4 m-80 -83.53 -23.84 31.89 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.692 1.597 . . . . 0.0 110.343 179.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.9 p -85.87 144.98 8.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-N 120.714 1.597 . . . . 0.0 108.884 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.6 t -146.3 176.56 9.67 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 126.21 1.804 . . . . 0.0 107.41 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 61.04 -146.9 47.55 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 123.312 0.482 . . . . 0.0 113.54 176.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.3 tt -47.11 -51.39 18.0 Favored 'General case' 0 C--N 1.335 -0.029 0 C-N-CA 126.079 1.752 . . . . 0.0 113.504 -175.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.45 -38.36 86.91 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 120.277 1.399 . . . . 0.0 111.174 -178.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.2 ttt180 -65.78 -47.65 74.46 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 175.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.83 -27.02 66.27 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.613 1.165 . . . . 0.0 112.991 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -50.82 -42.53 58.4 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 120.34 1.427 . . . . 0.0 110.281 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.7 m -54.62 -35.6 63.59 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 124.783 1.233 . . . . 0.0 110.256 -177.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.93 -26.33 74.48 Favored Glycine 0 CA--C 1.526 0.77 0 O-C-N 121.499 -0.75 . . . . 0.0 112.817 179.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.8 m -95.39 -8.69 34.9 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.545 1.538 . . . . 0.0 111.016 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -104.22 -29.66 10.68 Favored 'General case' 0 CA--C 1.514 -0.417 0 O-C-N 121.044 -1.035 . . . . 0.0 111.771 -175.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.1 mtpt -52.82 -35.24 56.79 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 118.932 0.787 . . . . 0.0 110.686 176.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.8 t -62.91 -37.64 87.77 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.73 0.695 . . . . 0.0 111.947 176.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.0 mt -63.43 -60.02 3.92 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 124.388 1.075 . . . . 0.0 109.665 -176.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.85 -30.96 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 117.726 -1.131 . . . . 0.0 109.886 176.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.66 -46.47 88.93 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 120.337 1.426 . . . . 0.0 109.887 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -56.32 -25.07 47.59 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 77.8 t -85.29 -62.51 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 21.2 t -68.77 27.25 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.887 1 C-N-CA 131.864 4.065 . . . . 0.0 113.706 -175.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -54.12 -26.55 28.03 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 119.789 -1.819 . . . . 0.0 115.098 -175.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -94.87 81.38 3.76 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 175.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -142.04 170.79 15.05 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 125.406 1.482 . . . . 0.0 108.752 176.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -87.55 -66.58 0.9 Allowed 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.71 176.24 12.62 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 128.856 2.863 . . . . 0.0 106.26 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.46 169.39 9.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.827 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -141.04 149.57 41.85 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 103.927 -2.62 . . . . 0.0 103.927 -175.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 48.4 t -121.94 128.67 75.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.7 mt -133.38 148.78 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 125.632 1.573 . . . . 0.0 107.976 -176.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 79.4 p -145.19 1.69 0.97 Allowed 'General case' 0 C--O 1.235 0.29 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -127.2 136.45 52.05 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 125.612 1.565 . . . . 0.0 107.387 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.43 -50.49 40.51 Favored 'General case' 0 CA--C 1.517 -0.302 0 C-N-CA 123.945 0.898 . . . . 0.0 110.683 177.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -33.92 76.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 118.01 0.368 . . . . 0.0 110.504 -175.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -67.51 -23.32 65.45 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.937 1.295 . . . . 0.0 110.781 175.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -85.1 -23.91 28.28 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 125.315 1.446 . . . . 0.0 112.728 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -58.45 123.81 17.46 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.21 0.914 . . . . 0.0 109.671 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.451 ' HB3' ' HE3' ' A' ' 129' ' ' LYS . 27.5 mt-10 -65.35 -19.54 66.0 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 121.35 -0.844 . . . . 0.0 113.274 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -51.98 -51.43 57.31 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.139 0.881 . . . . 0.0 112.779 -175.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -85.62 -24.31 27.18 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.045 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 41.9 mt -56.92 -38.59 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 119.783 1.174 . . . . 0.0 108.376 175.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.451 ' HE3' ' HB3' ' A' ' 125' ' ' GLU . 41.4 mttt -52.94 -50.64 63.63 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.196 0.598 . . . . 0.0 109.783 176.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.5 t -66.0 -35.31 80.21 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.184 1.394 . . . . 0.0 112.064 176.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -63.7 -47.88 79.37 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.285 0.948 . . . . 0.0 109.201 176.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.77 -34.34 77.03 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.976 0.91 . . . . 0.0 109.88 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -65.57 -42.89 91.28 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.103 0.865 . . . . 0.0 109.274 175.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? -61.72 -52.83 62.64 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.641 0.776 . . . . 0.0 109.756 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.691 0 C-N-CA 124.202 1.001 . . . . 0.0 112.499 176.045 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.556 0 CA-C-O 121.467 0.651 . . . . 0.0 111.406 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.2 m -134.72 168.78 18.39 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 127.239 2.215 . . . . 0.0 105.797 176.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 45.4 tttm -138.51 172.54 12.73 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 120.642 -1.286 . . . . 0.0 108.836 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -122.84 149.52 26.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -83.23 85.03 7.28 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 103.432 -2.803 . . . . 0.0 103.432 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -62.54 -23.72 67.13 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.484 -1.246 . . . . 0.0 113.119 -175.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -79.13 -57.5 3.7 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 119.874 1.215 . . . . 0.0 108.112 179.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.17 -35.61 81.36 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.714 -176.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 82.9 m -80.04 -32.77 39.47 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 119.054 0.843 . . . . 0.0 111.037 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.7 ttt-85 -66.78 -26.86 67.17 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 117.328 -1.32 . . . . 0.0 109.713 175.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.89 -62.46 1.65 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 120.44 1.473 . . . . 0.0 109.441 176.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.79 -47.59 73.8 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.289 0.636 . . . . 0.0 111.431 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -52.15 -46.92 65.61 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 122.44 0.296 . . . . 0.0 110.965 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -64.41 -40.74 96.36 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.1 -0.953 . . . . 0.0 111.35 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.7 mp -60.4 -61.38 2.64 Favored 'General case' 0 C--O 1.221 -0.419 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 175.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.1 t -58.15 -32.96 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 122.806 0.442 . . . . 0.0 111.914 -175.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.85 -26.35 63.23 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 119.234 0.925 . . . . 0.0 110.9 176.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -76.02 127.41 32.9 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 118.986 0.812 . . . . 0.0 110.201 -177.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -61.37 -28.18 69.05 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.808 -0.557 . . . . 0.0 111.113 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.78 1.37 78.82 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.578 1.085 . . . . 0.0 113.627 178.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.8 t -85.98 124.9 32.95 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 120.627 2.213 . . . . 0.0 107.856 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.4 -33.12 71.01 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.9 t -64.73 131.01 30.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 C-N-CA 125.067 1.347 . . . . 0.0 107.389 175.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.3 pp -114.19 -23.62 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.448 1.499 . . . . 0.0 111.037 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.1 p-90 -131.74 146.89 52.41 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 118.814 0.733 . . . . 0.0 111.201 178.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 39.9 t -141.46 150.25 19.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 175.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.403 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 38.8 p -103.62 161.74 13.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -130.79 137.96 49.69 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 105.886 -1.894 . . . . 0.0 105.886 175.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -125.61 177.04 6.46 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 126.664 1.985 . . . . 0.0 107.396 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -118.52 137.28 53.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -133.96 123.83 25.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 175.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 58.3 -80.81 0.01 OUTLIER Glycine 0 CA--C 1.529 0.925 0 C-N-CA 126.005 1.764 . . . . 0.0 113.896 176.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.53 10.03 3.71 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.747 2.419 . . . . 0.0 113.664 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -149.82 173.24 13.97 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 120.266 1.394 . . . . 0.0 113.047 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 18.6 mm -84.28 140.03 16.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 175.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.4 m -131.17 160.52 66.63 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 125.482 1.513 . . . . 0.0 110.781 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.55 156.53 36.21 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.497 2.131 . . . . 0.0 109.94 175.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -126.46 -166.83 12.3 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 126.141 1.829 . . . . 0.0 109.532 175.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -54.05 161.67 1.18 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 117.948 0.874 . . . . 0.0 112.891 175.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.8 pm0 -141.79 164.71 29.46 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 127.582 2.353 . . . . 0.0 110.653 -175.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -167.03 172.73 42.2 Favored Glycine 0 CA--C 1.525 0.675 0 CA-C-O 121.837 0.687 . . . . 0.0 111.652 176.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -111.93 -2.7 15.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.647 1.179 . . . . 0.0 112.663 -176.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -139.47 150.41 45.14 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -83.6 -9.85 58.64 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.755 0.707 . . . . 0.0 111.875 -175.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -58.49 -39.57 80.38 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 120.597 -1.314 . . . . 0.0 110.252 175.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -76.21 -14.41 60.15 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.986 1.315 . . . . 0.0 112.781 176.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -72.84 -36.8 67.54 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 123.552 0.741 . . . . 0.0 110.147 175.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.7 mm -55.76 -44.97 79.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.31 0.644 . . . . 0.0 109.841 -175.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -61.72 -23.56 66.22 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.358 1.063 . . . . 0.0 113.495 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -70.99 -30.92 67.31 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.628 1.104 . . . . 0.0 112.1 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 56.7 m -72.25 113.58 9.44 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 105.513 -2.032 . . . . 0.0 105.513 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.265 2.5 p -115.31 166.82 11.44 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.646 1.178 . . . . 0.0 113.273 -175.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.434 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 3.5 p-10 -40.47 -69.45 0.13 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 131.008 3.723 . . . . 0.0 119.286 -174.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.434 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 4.8 t70 -106.05 -36.21 7.01 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.535 1.934 . . . . 0.0 115.974 -174.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 33.7 m -69.06 167.44 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-O 123.244 1.497 . . . . 0.0 114.615 -175.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.66 145.37 38.07 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 103.206 -2.887 . . . . 0.0 103.206 174.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.2 tp -144.33 165.05 29.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 119.869 1.213 . . . . 0.0 107.751 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -130.89 152.58 50.07 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 176.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.403 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -152.97 135.51 15.18 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 119.037 0.835 . . . . 0.0 112.412 175.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -95.83 123.18 39.3 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 104.906 -2.257 . . . . 0.0 104.906 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 50.3 t -133.87 137.94 51.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -176.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -78.13 138.62 38.81 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -135.99 161.63 35.12 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.842 1.657 . . . . 0.0 107.489 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.3 m . . . . . 0 N--CA 1.452 -0.344 0 O-C-N 120.755 -1.216 . . . . 0.0 108.473 -177.887 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.5 m . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.69 154.09 30.46 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.983 0.897 . . . . 0.0 108.984 -178.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -127.73 163.33 24.55 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.519 1.528 . . . . 0.0 108.297 -178.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.6 t -146.35 142.64 28.44 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -138.71 170.2 16.43 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.919 1.688 . . . . 0.0 106.966 176.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -146.38 129.77 16.77 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.8 133.93 49.74 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -99.88 113.21 25.6 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 102.296 -3.224 . . . . 0.0 102.296 175.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.2 mp -91.4 141.31 14.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -123.59 123.21 40.08 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 101.762 -3.422 . . . . 0.0 101.762 175.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.7 t-105 -95.44 123.41 38.96 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 103.84 -2.652 . . . . 0.0 103.84 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.8 mt -142.41 85.7 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 102.384 -3.191 . . . . 0.0 102.384 175.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.69 144.48 7.19 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 176.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.9 tm-20 -57.28 -18.56 17.11 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -83.85 -36.23 23.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 124.778 1.231 . . . . 0.0 112.426 -177.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -73.87 123.32 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 107.216 -1.401 . . . . 0.0 107.216 175.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 5.1 t -146.22 176.38 9.79 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.717 1.207 . . . . 0.0 108.942 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 84.47 -148.7 24.13 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.743 -0.598 . . . . 0.0 111.719 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -54.75 -29.9 55.05 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.46 1.104 . . . . 0.0 109.309 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -57.64 -43.57 84.98 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.058 -1.026 . . . . 0.0 110.82 175.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -43.54 74.8 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 175.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.05 -31.07 64.8 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.237 0.615 . . . . 0.0 112.115 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -59.4 -61.42 2.64 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 175.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 96.4 m -53.75 -40.01 65.8 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 122.656 0.383 . . . . 0.0 110.676 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.68 -22.25 61.62 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 123.592 0.615 . . . . 0.0 114.296 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 63.7 m -108.49 -8.1 15.62 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.104 1.361 . . . . 0.0 111.902 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -103.27 -24.74 13.51 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.767 1.227 . . . . 0.0 112.189 -175.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.513 ' HZ2' ' HG3' ' A' ' 114' ' ' GLU . 54.7 mtpt -55.62 -33.27 63.84 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 120.294 1.406 . . . . 0.0 111.383 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.2 t -59.36 -36.84 76.48 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.95 0.795 . . . . 0.0 112.075 175.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 12.7 mt -63.19 -63.84 1.08 Allowed 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 125.14 1.376 . . . . 0.0 109.319 -175.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -32.88 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-O 117.73 -1.128 . . . . 0.0 109.793 175.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.81 -37.41 86.62 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.75 1.614 . . . . 0.0 110.418 176.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.33 -24.77 65.3 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.308 0.958 . . . . 0.0 111.374 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 58.9 t -84.98 -54.02 9.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 175.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 72.1 t -71.85 14.01 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 130.269 3.428 . . . . 0.0 113.35 -175.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -50.25 -26.55 4.84 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 119.759 -1.838 . . . . 0.0 115.119 -175.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -92.32 52.08 1.88 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.241 1.017 . . . . 0.0 109.646 175.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.08 176.46 5.12 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.72 2.008 . . . . 0.0 110.705 177.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.8 -67.07 0.86 Allowed 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -165.09 176.17 8.76 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 128.495 2.718 . . . . 0.0 108.734 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.513 ' HG3' ' HZ2' ' A' ' 101' ' ' LYS . 0.6 OUTLIER -113.61 173.61 6.33 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 124.663 1.185 . . . . 0.0 111.685 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -147.54 155.99 42.4 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 105.156 -2.164 . . . . 0.0 105.156 -175.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 14.3 t -129.08 124.9 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 175.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mt -125.19 141.29 45.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 125.804 1.641 . . . . 0.0 107.867 -175.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 10.2 p -131.07 -9.81 3.81 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -175.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -145.97 160.64 41.57 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 118.447 0.567 . . . . 0.0 110.771 -175.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -53.38 -42.86 67.35 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.254 1.421 . . . . 0.0 111.204 176.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -67.47 -37.15 82.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.636 0.653 . . . . 0.0 111.989 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -71.77 -23.66 61.63 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.896 0.879 . . . . 0.0 110.545 177.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -80.77 -24.56 38.55 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.095 -1.003 . . . . 0.0 113.38 -176.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -61.5 123.61 18.34 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.904 0.774 . . . . 0.0 111.492 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -54.66 -23.61 18.1 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -56.42 -49.99 72.95 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 -175.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -88.94 -25.65 21.96 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.873 177.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 34.5 mt -52.7 -43.41 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -55.0 -50.48 68.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 119.083 -0.484 . . . . 0.0 111.048 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.5 t -64.08 -43.32 95.77 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-O 118.803 -0.618 . . . . 0.0 110.604 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -53.65 -52.81 58.75 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.543 1.137 . . . . 0.0 109.372 177.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.12 -29.29 70.13 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.008 0.923 . . . . 0.0 112.159 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -72.29 -44.27 63.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.393 1.077 . . . . 0.0 110.018 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 45.8 mmtt -60.53 -53.53 56.46 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 176.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.361 0 C-N-CA 125.186 1.394 . . . . 0.0 113.103 178.5 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.3 m -64.05 157.33 25.54 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.51 2.324 . . . . 0.0 108.409 176.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -131.74 175.44 9.19 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.266 1.026 . . . . 0.0 110.119 -176.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -121.42 151.98 24.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 O-C-N 121.541 -0.725 . . . . 0.0 110.247 176.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -87.19 65.71 8.95 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 104.87 -2.271 . . . . 0.0 104.87 175.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.93 -39.93 63.22 Favored 'General case' 0 CA--C 1.512 -0.482 0 C-N-CA 124.395 1.078 . . . . 0.0 111.931 -175.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -67.84 -35.23 78.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 118.753 0.706 . . . . 0.0 111.771 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.29 -50.26 16.64 Favored 'General case' 0 CA--C 1.523 -0.084 0 CA-C-N 119.727 1.149 . . . . 0.0 109.882 175.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.0 m -62.36 -27.79 69.31 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.906 -0.496 . . . . 0.0 110.996 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -58.52 -41.61 85.84 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 117.72 -1.133 . . . . 0.0 109.518 175.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.54 -54.32 38.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 123.779 0.674 . . . . 0.0 110.116 -175.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.08 75.15 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -52.94 -40.66 63.82 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 119.015 -0.517 . . . . 0.0 109.618 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -58.43 -48.77 79.62 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 123.448 0.699 . . . . 0.0 111.013 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mp -54.33 -56.36 19.25 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 124.029 0.932 . . . . 0.0 110.856 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.0 -30.08 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 122.146 -0.346 . . . . 0.0 111.089 -176.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.0 ttp85 -76.89 -25.05 52.59 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.382 1.073 . . . . 0.0 112.273 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -83.67 124.35 30.75 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 126.185 1.794 . . . . 0.0 112.313 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -64.83 -22.27 66.95 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 123.924 0.89 . . . . 0.0 112.869 175.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.76 -14.35 75.77 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-N 119.169 0.895 . . . . 0.0 112.854 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.5 t -70.13 146.03 51.13 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.898 1.349 . . . . 0.0 111.942 -175.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.03 -29.58 23.34 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 175.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.8 t -74.86 129.95 36.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 176.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.87 -24.02 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 O-C-N 124.296 0.997 . . . . 0.0 110.235 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -125.45 144.65 50.43 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 124.349 1.06 . . . . 0.0 109.275 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.9 t -137.53 162.78 32.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 C-N-CA 128.501 2.72 . . . . 0.0 107.631 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.441 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 51.0 p -132.06 162.22 31.31 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.601 1.161 . . . . 0.0 108.174 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -133.92 143.82 48.46 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -120.64 176.67 5.4 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.537 ' HH ' ' HB3' ' A' ' 100' ' ' ASP . 23.9 m-85 -120.33 141.01 50.42 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.479 0.712 . . . . 0.0 109.118 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -151.09 123.83 8.56 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.066 0.946 . . . . 0.0 109.285 175.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 54.19 -125.9 34.91 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.1 p -98.34 30.05 3.34 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 124.516 1.127 . . . . 0.0 111.945 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.6 t -151.84 165.4 34.62 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 175.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 12.2 mm -89.41 135.03 27.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 103.743 -2.688 . . . . 0.0 103.743 175.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.34 167.19 14.66 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 124.687 1.195 . . . . 0.0 109.297 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -66.06 170.08 12.4 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 CA-C-N 120.506 1.216 . . . . 0.0 111.302 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -135.41 -168.11 11.5 Favored Glycine 0 CA--C 1.523 0.559 0 C-N-CA 125.614 1.578 . . . . 0.0 109.85 176.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -74.69 170.46 15.78 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 124.566 1.146 . . . . 0.0 109.731 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -146.46 168.47 21.12 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 124.949 1.3 . . . . 0.0 110.206 -176.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.33 -178.03 46.67 Favored Glycine 0 CA--C 1.521 0.41 0 CA-C-O 121.968 0.76 . . . . 0.0 112.772 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.76 -24.11 7.31 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.552 1.541 . . . . 0.0 110.776 176.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -109.12 123.21 48.83 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -83.1 -15.88 49.08 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.368 -175.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -54.11 -34.54 60.52 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 121.468 1.94 . . . . 0.0 111.666 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -66.16 -32.98 74.75 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 123.429 0.692 . . . . 0.0 112.123 175.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.95 -45.59 67.79 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.292 1.437 . . . . 0.0 109.622 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 mp -63.46 -33.12 59.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.507 -0.745 . . . . 0.0 110.958 -178.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -80.21 -26.45 39.15 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.961 1.304 . . . . 0.0 110.269 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -71.98 -39.02 69.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.451 1.5 . . . . 0.0 110.278 176.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 67.4 m -50.49 114.36 1.11 Allowed 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.953 1.301 . . . . 0.0 111.246 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 p -84.26 143.24 29.69 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 127.995 2.518 . . . . 0.0 110.635 -176.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -50.54 -59.74 3.72 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 126.172 1.789 . . . . 0.0 112.94 -177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -106.67 -33.79 7.51 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 125.496 1.518 . . . . 0.0 113.927 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.5 m -72.31 155.11 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 C-N-CA 118.086 -1.446 . . . . 0.0 109.429 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.7 151.44 22.99 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -178.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.3 tp -147.48 157.35 43.53 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 124.424 1.09 . . . . 0.0 108.478 -175.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -128.84 142.77 50.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.441 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -137.46 124.08 21.01 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 123.838 0.855 . . . . 0.0 112.001 -176.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -95.85 123.57 39.49 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 105.27 -2.122 . . . . 0.0 105.27 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.9 t -136.53 143.57 35.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 123.365 0.666 . . . . 0.0 109.395 -175.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.52 136.2 33.21 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -136.27 170.76 15.51 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.755 2.022 . . . . 0.0 107.81 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--O 1.235 0.298 0 C-N-CA 125.639 1.576 . . . . 0.0 110.116 176.349 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.5 m . . . . . 0 N--CA 1.442 -0.861 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -67.79 154.57 41.23 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 87.9 mtt-85 -111.8 165.68 11.85 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.7 t -133.51 135.99 44.78 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.7 mtpp -139.87 123.97 17.75 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 125.933 1.693 . . . . 0.0 107.791 -175.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.57 134.76 33.62 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 176.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -108.01 127.9 54.18 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.542 1.537 . . . . 0.0 107.169 176.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -103.99 113.27 26.69 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 175.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.8 mp -93.74 135.46 28.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 -177.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -117.38 123.47 46.52 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 106.071 -1.825 . . . . 0.0 106.071 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 52.1 t-105 -100.96 123.41 45.11 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 105.745 -1.946 . . . . 0.0 105.745 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.7 mm -141.56 89.84 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 101.001 -3.703 . . . . 0.0 101.001 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.48 145.0 8.25 Favored Glycine 0 C--N 1.339 0.726 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.44 -5.44 7.72 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.103 0.951 . . . . 0.0 113.134 -175.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -83.3 -35.5 25.2 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 124.799 1.24 . . . . 0.0 111.771 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.2 p -82.71 132.78 30.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 120.074 1.307 . . . . 0.0 109.656 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.5 t -146.22 176.56 9.66 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 126.674 1.99 . . . . 0.0 108.589 -175.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 81.29 -155.48 36.2 Favored Glycine 0 CA--C 1.519 0.311 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.49 -29.56 59.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 122.963 0.505 . . . . 0.0 110.959 -177.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 -57.22 -39.41 75.42 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.872 1.669 . . . . 0.0 111.334 176.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -71.45 -53.05 15.28 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 175.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.65 -23.39 6.49 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 117.225 -1.369 . . . . 0.0 113.527 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -48.82 -44.11 38.98 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 120.678 1.581 . . . . 0.0 109.184 175.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.2 m -56.29 -27.78 56.57 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.983 1.713 . . . . 0.0 111.918 178.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -75.95 -25.92 65.75 Favored Glycine 0 CA--C 1.529 0.943 0 O-C-N 120.809 -1.182 . . . . 0.0 112.449 175.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 54.6 m -93.32 -20.18 20.64 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.806 1.242 . . . . 0.0 110.136 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . 0.537 ' HB3' ' HH ' ' A' ' 34' ' ' TYR . 79.4 m-20 -104.14 -23.97 13.22 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -174.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -58.14 -33.04 68.75 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 122.353 2.342 . . . . 0.0 111.225 177.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.9 t -68.53 -27.49 66.15 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.663 1.12 . . . . 0.0 112.25 175.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 15.5 mt -67.85 -62.16 1.54 Allowed 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.301 0.8 OUTLIER -57.87 -24.69 23.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.313 175.471 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -63.79 -33.19 75.11 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.814 1.643 . . . . 0.0 109.57 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -62.34 -24.26 67.23 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 120.665 1.575 . . . . 0.0 111.816 175.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 92.2 t -86.01 -63.4 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 41.5 t -73.13 26.16 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 131.64 3.976 . . . . 0.0 112.71 -175.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -54.25 -26.0 26.41 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 119.751 -1.843 . . . . 0.0 111.643 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -97.37 88.84 4.52 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 175.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -153.08 176.44 11.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.436 0.636 . . . . 0.0 111.003 176.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -108.61 -66.03 1.08 Allowed 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.432 1.093 . . . . 0.0 109.982 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.98 174.88 11.11 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 119.044 0.838 . . . . 0.0 109.464 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . 0.254 0.0 OUTLIER -118.84 169.62 9.7 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.625 1.17 . . . . 0.0 109.599 175.495 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -144.15 149.15 36.02 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 104.205 -2.517 . . . . 0.0 104.205 -175.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.31 123.47 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.8 mp -130.87 145.22 35.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 125.286 1.434 . . . . 0.0 107.889 -176.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 p -136.65 -9.46 1.88 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.741 1.216 . . . . 0.0 113.76 -176.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -115.42 124.46 51.22 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 176.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 17.8 ttp-105 -59.49 -36.68 76.52 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.92 0.888 . . . . 0.0 111.721 -177.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -35.96 77.05 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 120.254 1.388 . . . . 0.0 111.422 177.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.88 -41.52 91.48 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 123.744 0.653 . . . . 0.0 110.324 -175.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -43.61 -23.11 0.06 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 131.456 3.903 . . . . 0.0 115.425 -176.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -43.93 141.41 1.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.014 1.726 . . . . 0.0 111.222 175.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -61.42 -21.84 64.46 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -175.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.471 ' HA ' ' HE3' ' A' ' 129' ' ' LYS 0.276 7.9 t70 -65.81 -43.57 88.27 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 121.541 1.973 . . . . 0.0 113.448 -175.168 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.16 -26.39 60.28 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 113.84 -3.144 . . . . 0.0 106.44 -176.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 58.5 mt -60.64 -49.54 84.04 Favored 'Isoleucine or valine' 0 C--N 1.345 0.39 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 175.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.471 ' HE3' ' HA ' ' A' ' 126' ' ' ASP . 15.4 mtmt -56.26 -45.91 79.88 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.554 -0.716 . . . . 0.0 111.327 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -73.53 -38.17 65.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 119.403 1.002 . . . . 0.0 110.904 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -66.52 -43.73 84.42 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.51 1.524 . . . . 0.0 109.879 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.06 -36.69 82.39 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -67.2 -41.4 85.88 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 124.551 1.14 . . . . 0.0 111.429 175.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -62.02 -41.35 97.99 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 120.832 1.651 . . . . 0.0 109.135 175.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.661 0 C-N-CA 123.667 0.787 . . . . 0.0 112.212 175.742 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 61.2 m -116.23 161.14 19.42 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 103.766 -2.679 . . . . 0.0 103.766 175.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.559 ' HG2' ' H ' ' A' ' 8' ' ' ILE . 38.6 tttt -132.26 -174.01 3.32 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 121.144 -0.973 . . . . 0.0 110.555 -175.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.559 ' H ' ' HG2' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -132.39 151.68 35.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 125.825 1.65 . . . . 0.0 108.298 175.647 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -103.2 86.32 2.66 Favored 'General case' 0 C--O 1.236 0.352 1 N-CA-C 98.488 -4.634 . . . . 0.0 98.488 174.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -55.13 -29.37 57.57 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 116.899 -1.524 . . . . 0.0 113.757 -175.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -74.33 -50.43 18.78 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 120.878 1.672 . . . . 0.0 110.222 -176.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.14 90.0 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.1 m -68.88 -41.95 77.63 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.526 -0.734 . . . . 0.0 112.117 175.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -57.06 -37.62 72.09 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 117.85 -1.071 . . . . 0.0 109.855 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.27 -35.6 69.96 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 119.005 0.82 . . . . 0.0 111.984 -176.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.43 -50.17 12.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 119.185 0.902 . . . . 0.0 111.274 175.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -49.47 -43.76 45.39 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.757 1.223 . . . . 0.0 110.13 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -64.77 -43.38 93.44 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 118.348 -0.834 . . . . 0.0 111.841 -177.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.79 -52.26 65.82 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 119.224 0.92 . . . . 0.0 111.385 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 93.8 t -60.35 -34.27 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 122.439 0.296 . . . . 0.0 110.216 -177.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.4 ttt-85 -72.56 -32.57 66.14 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 125.158 1.383 . . . . 0.0 113.124 176.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.22 149.3 50.54 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.957 1.303 . . . . 0.0 113.887 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.57 -23.21 34.57 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.781 1.233 . . . . 0.0 113.162 -177.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.77 -14.67 24.55 Favored Glycine 0 CA--C 1.527 0.807 0 CA-C-N 118.782 0.719 . . . . 0.0 112.538 -177.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -64.95 123.71 20.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 118.304 1.052 . . . . 0.0 109.214 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.07 -31.94 69.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.248 175.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 t -60.62 129.41 23.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 176.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -114.69 -24.43 3.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 124.075 0.859 . . . . 0.0 110.603 178.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -129.68 137.84 50.84 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.646 1.112 . . . . 0.0 109.685 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 23.6 t -140.6 148.39 22.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 175.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.443 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 42.1 p -105.56 160.32 15.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.133 0.492 . . . . 0.0 111.324 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -129.25 123.08 31.03 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 104.347 -2.464 . . . . 0.0 104.347 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.0 mmtm -100.49 176.66 5.27 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 127.407 2.283 . . . . 0.0 105.921 177.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -115.82 153.62 31.15 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -137.74 152.96 49.75 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 128.991 2.916 . . . . 0.0 105.86 175.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 12.87 -80.33 0.0 OUTLIER Glycine 0 C--N 1.339 0.737 0 C-N-CA 128.038 2.732 . . . . 0.0 115.67 175.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.9 p -129.8 23.91 5.37 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.515 1.126 . . . . 0.0 113.569 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.0 t -151.21 171.63 17.1 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -176.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 12.3 mm -92.93 139.61 17.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 C-N-CA 125.898 1.679 . . . . 0.0 107.439 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.6 m -131.48 153.93 81.73 Favored Pre-proline 0 N--CA 1.472 0.628 0 C-N-CA 124.436 1.094 . . . . 0.0 111.387 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.33 153.71 50.78 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 121.736 1.624 . . . . 0.0 109.491 175.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.69 -142.62 6.97 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 125.484 1.516 . . . . 0.0 110.744 177.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -72.73 165.39 24.9 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.841 1.256 . . . . 0.0 109.755 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -145.08 165.1 29.21 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 125.772 1.629 . . . . 0.0 110.809 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.6 173.78 42.01 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-O 122.731 1.184 . . . . 0.0 112.962 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.46 7.47 5.34 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.484 2.314 . . . . 0.0 110.093 176.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -133.03 127.04 33.21 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 103.422 -2.807 . . . . 0.0 103.422 -175.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -84.43 -15.99 44.22 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 115.611 1.708 . . . . 0.0 115.611 -175.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -58.7 -40.19 82.92 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 121.959 2.163 . . . . 0.0 109.937 176.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -60.47 -30.58 69.77 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.767 0.427 . . . . 0.0 111.039 175.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -69.66 -36.12 75.77 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.539 -0.726 . . . . 0.0 109.652 178.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.5 mm -62.87 -46.95 95.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -63.6 -35.96 82.23 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.863 1.665 . . . . 0.0 111.926 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.0 -22.98 65.04 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 124.716 1.207 . . . . 0.0 114.049 177.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.9 m -64.23 113.99 3.94 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 119.377 0.989 . . . . 0.0 108.83 -178.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.833 ' HG1' ' CG2' ' A' ' 59' ' ' VAL 0.254 2.3 p -103.36 154.85 18.96 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.495 1.118 . . . . 0.0 108.168 179.628 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -41.48 -74.76 0.03 OUTLIER 'General case' 0 C--O 1.234 0.272 0 N-CA-C 117.943 2.572 . . . . 0.0 117.943 -174.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -106.17 -36.14 6.99 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -175.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.833 ' CG2' ' HG1' ' A' ' 56' ' ' THR . 15.7 m -53.75 132.16 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 123.235 0.614 . . . . 0.0 110.265 -175.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.51 123.11 46.3 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 -177.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 32.7 tp -122.42 176.11 6.07 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 127.023 2.129 . . . . 0.0 111.284 -174.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -136.48 151.76 49.81 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.49 0.716 . . . . 0.0 110.233 176.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.443 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -142.92 123.42 13.99 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.739 0.815 . . . . 0.0 111.295 175.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -88.41 123.88 33.4 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 104.65 -2.352 . . . . 0.0 104.65 175.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.4 t -134.28 140.54 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-N 118.103 0.41 . . . . 0.0 109.919 -175.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.9 tmm_? -85.42 117.84 24.59 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 175.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -112.23 123.45 50.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 108.696 -175.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.1 m . . . . . 0 N--CA 1.447 -0.579 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 176.258 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.1 m . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -57.09 150.2 17.75 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 123.455 0.702 . . . . 0.0 109.703 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 75.2 mmt-85 -135.4 134.04 39.29 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 175.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.2 t -146.59 139.12 25.11 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 124.461 1.105 . . . . 0.0 108.316 -176.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -142.41 176.63 8.85 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.508 1.523 . . . . 0.0 107.214 177.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -131.52 124.35 29.91 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 -176.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -111.56 114.12 26.98 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 104.108 -2.553 . . . . 0.0 104.108 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.9 tt -82.88 113.15 20.3 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 105.361 -2.088 . . . . 0.0 105.361 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.1 mp -79.4 123.8 36.8 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 N-CA-C 105.458 -2.053 . . . . 0.0 105.458 175.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.8 m -106.4 123.11 47.57 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 101.242 -3.614 . . . . 0.0 101.242 175.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -95.49 124.06 39.34 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.5 mm -133.94 81.92 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 N-CA-C 103.696 -2.705 . . . . 0.0 103.696 177.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -44.26 130.47 7.09 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 107.986 -2.046 . . . . 0.0 107.986 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -56.0 -10.64 0.84 Allowed 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -83.21 -28.17 29.45 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 117.576 -1.202 . . . . 0.0 110.804 177.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.7 p -71.03 133.53 31.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 120.744 1.611 . . . . 0.0 109.064 -177.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 42.5 t -146.31 176.18 9.96 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.84 1.656 . . . . 0.0 107.011 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.65 -157.2 53.52 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.1 tt -60.23 -30.98 69.76 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-O 118.049 -0.977 . . . . 0.0 112.047 -175.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -58.17 -45.15 87.98 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 120.304 1.411 . . . . 0.0 110.109 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -36.25 76.98 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 175.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.32 -23.57 66.82 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.084 -0.96 . . . . 0.0 112.573 177.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -56.19 -54.35 46.25 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-N 119.919 1.236 . . . . 0.0 108.861 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 54.0 m -52.28 -40.41 61.72 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 175.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -55.4 -24.78 39.22 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-O 118.864 -0.964 . . . . 0.0 115.415 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.2 m -115.7 -6.64 12.15 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.184 1.492 . . . . 0.0 112.201 176.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -103.91 -23.46 13.36 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 125.733 1.613 . . . . 0.0 111.974 -175.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.4 mtmp? -53.31 -29.88 36.0 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.44 1.473 . . . . 0.0 111.981 176.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -63.69 -36.83 85.15 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.942 0.897 . . . . 0.0 111.137 176.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 18.1 mt -64.81 -62.27 1.67 Allowed 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 125.363 1.465 . . . . 0.0 108.723 -176.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.264 0.9 OUTLIER -61.14 -28.1 43.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.472 176.354 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 34.1 tttm -62.14 -40.56 96.35 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 121.246 1.839 . . . . 0.0 109.43 175.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -57.51 -24.51 56.33 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.687 1.13 . . . . 0.0 112.253 177.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 55.3 t -84.62 -63.24 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 87.1 t -65.22 26.46 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.873 1 C-N-CA 132.289 4.236 . . . . 0.0 113.644 -175.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -54.12 -27.05 30.81 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 119.314 -2.116 . . . . 0.0 114.035 -175.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -90.78 79.86 5.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 175.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -148.58 176.32 10.43 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 122.375 0.27 . . . . 0.0 110.591 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.42 -59.29 2.02 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.982 0.913 . . . . 0.0 111.04 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -147.54 171.94 14.77 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 125.335 1.454 . . . . 0.0 110.248 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -123.51 134.02 53.93 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -107.1 144.37 33.89 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 104.998 -2.223 . . . . 0.0 104.998 -174.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.6 t -104.0 123.54 57.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 175.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 98.9 mt -129.08 137.25 57.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 106.225 -1.768 . . . . 0.0 106.225 -175.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.5 p -142.69 -4.01 0.98 Allowed 'General case' 0 C--O 1.239 0.528 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -175.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -146.82 152.13 38.24 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.103 1.361 . . . . 0.0 109.229 -175.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -60.11 -36.17 76.85 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 117.313 -1.327 . . . . 0.0 112.361 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -63.08 -37.45 87.27 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 121.273 1.851 . . . . 0.0 110.584 176.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -68.13 -23.17 64.86 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.108 2.163 . . . . 0.0 111.485 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -84.82 -23.37 29.13 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.256 1.822 . . . . 0.0 113.349 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -59.35 125.76 24.9 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 120.102 1.319 . . . . 0.0 112.12 -175.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -56.9 -27.93 61.33 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.254 -0.904 . . . . 0.0 113.316 176.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -54.59 -60.68 3.03 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 123.575 0.75 . . . . 0.0 111.249 -177.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -80.56 -24.22 39.39 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 117.769 -1.572 . . . . 0.0 109.017 -175.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 27.8 mt -54.47 -47.34 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 175.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -54.09 -49.89 68.07 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 118.78 0.718 . . . . 0.0 112.038 175.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.8 t -71.91 -29.16 64.02 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.598 0.635 . . . . 0.0 111.661 -176.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -72.11 -47.14 53.43 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 119.301 0.955 . . . . 0.0 109.165 176.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 78.0 mt -60.17 -36.95 78.73 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 175.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.0 mtmt -61.68 -53.21 59.21 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 175.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? -57.05 -45.77 82.96 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.976 1.262 . . . . 0.0 111.209 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 CA-C-O 117.964 -1.017 . . . . 0.0 112.873 179.145 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.2 m -142.6 162.07 36.42 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.565 1.946 . . . . 0.0 106.621 -176.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.1 mtpt -131.62 -173.06 3.02 Favored 'General case' 0 CA--C 1.516 -0.328 0 O-C-N 121.316 -0.865 . . . . 0.0 111.303 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.13 148.38 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 C-N-CA 126.908 2.083 . . . . 0.0 105.654 175.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -88.31 74.05 8.74 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 101.9 -3.37 . . . . 0.0 101.9 175.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.85 -44.61 59.52 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 125.391 1.477 . . . . 0.0 112.875 -174.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -65.47 -49.34 69.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.083 0.856 . . . . 0.0 109.738 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.56 -34.39 74.11 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.322 -0.861 . . . . 0.0 112.0 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.5 m -74.78 -38.02 62.27 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.451 178.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.2 ttm180 -59.95 -27.25 66.65 Favored 'General case' 0 C--N 1.342 0.263 0 CA-C-O 116.975 -1.488 . . . . 0.0 111.17 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.06 -60.78 3.24 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 120.089 1.313 . . . . 0.0 110.465 176.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.38 -40.2 95.66 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.013 0.824 . . . . 0.0 111.073 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -58.77 -36.34 74.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.545 176.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -62.19 -44.96 95.41 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 119.925 1.239 . . . . 0.0 110.604 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.6 mp -56.68 -61.84 2.14 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 175.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 42.3 t -58.21 -34.44 49.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 O-C-N 121.742 -0.599 . . . . 0.0 111.498 -176.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.2 ttt-85 -67.71 -38.16 83.25 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 124.683 1.193 . . . . 0.0 111.213 175.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -66.56 137.07 56.5 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.891 0.876 . . . . 0.0 108.737 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.6 -11.06 57.8 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 125.279 1.432 . . . . 0.0 111.373 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -98.45 5.85 60.82 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.724 1.63 . . . . 0.0 112.225 175.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -85.63 141.55 29.72 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.248 1.524 . . . . 0.0 109.936 176.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -80.28 -29.0 38.24 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 175.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.9 t -73.62 125.03 32.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 175.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 pp -115.16 -24.49 3.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.816 1.246 . . . . 0.0 111.312 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.0 p-90 -125.38 145.21 50.15 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 119.224 0.92 . . . . 0.0 108.777 177.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.1 t -135.71 158.84 39.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 127.389 2.276 . . . . 0.0 106.151 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 42.0 p -119.15 154.5 33.19 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -126.69 123.58 37.85 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 176.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -107.04 176.72 5.08 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.171 2.188 . . . . 0.0 105.347 -175.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -116.94 155.53 28.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.485 0.659 . . . . 0.0 109.509 176.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -142.26 166.71 23.94 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 127.306 2.242 . . . . 0.0 105.906 175.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 14.07 -88.78 0.0 OUTLIER Glycine 0 CA--C 1.531 1.06 0 C-N-CA 128.385 2.898 . . . . 0.0 114.988 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 p -135.59 44.17 2.55 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 126.24 1.816 . . . . 0.0 109.312 175.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -155.1 174.29 15.39 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -176.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.3 mm -103.47 139.55 24.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 126.22 1.808 . . . . 0.0 106.968 175.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 16.6 m -135.66 160.54 67.25 Favored Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 124.98 1.312 . . . . 0.0 110.902 -178.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.87 149.11 53.15 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.525 2.15 . . . . 0.0 110.444 175.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -115.43 -145.95 8.72 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 126.706 2.098 . . . . 0.0 109.676 175.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -70.26 164.65 23.92 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -144.95 168.64 19.76 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.849 1.26 . . . . 0.0 108.49 175.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.81 174.92 46.91 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-O 121.88 0.711 . . . . 0.0 113.076 -177.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.64 -26.07 8.81 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.693 1.997 . . . . 0.0 110.691 176.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.02 129.18 55.45 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 -176.116 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -83.94 -8.5 59.15 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.404 1.261 . . . . 0.0 114.404 -174.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -58.56 -40.12 82.18 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 119.497 -2.002 . . . . 0.0 109.048 175.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -66.48 -22.54 66.19 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.597 -0.689 . . . . 0.0 111.601 176.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -66.61 -36.25 82.14 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-N 119.472 1.033 . . . . 0.0 109.801 176.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.9 mm -60.02 -39.7 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -72.7 -23.35 60.86 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.849 1.66 . . . . 0.0 113.313 175.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -73.97 -24.92 59.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 120.79 1.632 . . . . 0.0 110.036 175.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 79.9 m -71.56 159.37 34.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.598 -0.689 . . . . 0.0 109.432 176.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.7 p -132.63 -174.33 3.43 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.73 1.212 . . . . 0.0 112.644 -175.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -77.01 -67.46 0.71 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.304 1.442 . . . . 0.0 108.448 175.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -106.45 -27.92 10.64 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 -175.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.5 m -65.58 167.77 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-N 121.997 2.18 . . . . 0.0 113.428 -175.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.2 124.87 45.74 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 175.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 56.2 tp -129.02 159.09 37.02 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 126.171 1.788 . . . . 0.0 107.962 -175.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -123.81 157.82 33.21 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.442 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -147.2 141.62 26.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 118.126 0.421 . . . . 0.0 111.319 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -106.54 123.58 48.31 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 176.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.2 t -135.62 138.15 48.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.834 0.826 . . . . 0.0 112.136 -175.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.5 ttm-85 -79.33 117.71 20.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 128.388 2.675 . . . . 0.0 107.15 175.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -136.18 167.75 20.69 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.7 m . . . . . 0 C--N 1.327 -0.401 0 O-C-N 120.8 -1.187 . . . . 0.0 107.804 175.985 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 75.3 m . . . . . 0 N--CA 1.442 -0.827 0 N-CA-C 103.76 -2.681 . . . . 0.0 103.76 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -64.37 158.5 23.47 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.661 -176.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.9 mtt180 -116.61 170.87 8.25 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.7 t -145.64 124.3 12.54 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 175.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -116.64 123.35 47.07 Favored 'General case' 0 CA--C 1.5 -0.979 0 C-N-CA 125.753 1.621 . . . . 0.0 107.361 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -86.31 131.46 34.21 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.713 -1.131 . . . . 0.0 108.683 -178.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.68 122.19 45.56 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -95.21 113.22 24.88 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 101.029 -3.693 . . . . 0.0 101.029 174.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -97.41 143.17 13.05 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 -176.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.7 m -126.18 123.5 38.37 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 175.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.3 t-105 -100.85 128.09 47.03 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 104.021 -2.585 . . . . 0.0 104.021 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 mt -132.27 103.03 6.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 104.27 -2.492 . . . . 0.0 104.27 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.7 138.09 15.18 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 176.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -66.62 -7.22 18.93 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.747 -1.443 . . . . 0.0 111.953 -176.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -85.45 -34.78 21.58 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 117.188 -1.387 . . . . 0.0 113.072 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.39 124.1 18.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 120.941 1.701 . . . . 0.0 109.863 -175.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.8 t -65.82 162.13 19.5 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 122.616 1.198 . . . . 0.0 113.262 -175.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.02 -30.07 72.55 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 125.32 1.438 . . . . 0.0 113.715 -176.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.7 -46.95 87.5 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 118.478 1.139 . . . . 0.0 108.355 175.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -67.48 -41.96 83.71 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 123.171 0.588 . . . . 0.0 109.526 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -58.74 -24.95 62.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.739 0.7 . . . . 0.0 110.408 175.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.97 -39.17 93.87 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.061 -1.024 . . . . 0.0 110.531 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.65 -41.53 77.36 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 118.979 0.809 . . . . 0.0 108.849 176.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 m -59.1 -30.25 67.97 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.636 -176.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -70.88 -26.38 74.08 Favored Glycine 0 CA--C 1.532 1.128 0 CA-C-N 119.739 1.154 . . . . 0.0 112.448 175.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 33.5 m -89.48 -10.92 44.54 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.425 1.49 . . . . 0.0 109.974 175.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -103.46 -27.82 12.16 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.422 -0.799 . . . . 0.0 111.375 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -53.5 -51.94 61.18 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 119.767 1.167 . . . . 0.0 109.745 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -58.67 -34.62 71.46 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 123.455 0.702 . . . . 0.0 110.88 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 14.8 mt -64.09 -62.39 1.66 Allowed 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 124.014 0.926 . . . . 0.0 110.074 178.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.253 0.9 OUTLIER -60.32 -25.72 34.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 118.481 -1.288 . . . . 0.0 110.224 176.503 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -67.92 -26.41 65.96 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 120.534 1.515 . . . . 0.0 109.729 175.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.68 -25.98 68.45 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.957 1.708 . . . . 0.0 110.729 175.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 79.0 t -86.16 -58.01 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 175.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 60.7 t -73.4 26.32 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 130.358 3.463 . . . . 0.0 111.695 -175.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.43 -26.19 64.97 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 119.814 -1.804 . . . . 0.0 111.261 -176.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -91.94 70.91 5.55 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 175.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.13 175.94 8.94 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.044 0.449 . . . . 0.0 111.001 176.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.85 -66.33 0.94 Allowed 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 108.696 -0.854 . . . . 0.0 108.696 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.97 175.08 13.44 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 128.343 2.657 . . . . 0.0 107.233 175.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -100.52 178.5 4.71 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 124.509 1.124 . . . . 0.0 112.692 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -143.43 144.54 32.07 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 103.712 -2.699 . . . . 0.0 103.712 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 57.5 t -123.22 131.12 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 175.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -129.64 147.99 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 126.551 1.94 . . . . 0.0 109.335 -175.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.3 p -146.02 9.42 1.13 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.507 1.123 . . . . 0.0 113.08 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -142.51 147.11 35.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -178.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -62.59 -24.22 67.45 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 119.777 1.172 . . . . 0.0 110.213 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -68.34 -55.05 13.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 175.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -56.73 -23.48 42.84 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.706 1.602 . . . . 0.0 111.073 175.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -79.68 -22.84 42.96 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.491 1.916 . . . . 0.0 113.482 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -60.22 124.77 21.29 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 119.488 1.04 . . . . 0.0 112.667 -177.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -58.27 -26.71 63.29 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 176.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -48.71 -66.32 0.42 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.181 1.792 . . . . 0.0 111.182 177.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -78.19 -21.76 49.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 117.077 -1.849 . . . . 0.0 108.768 -176.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 72.6 mt -55.13 -43.02 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 120.03 1.286 . . . . 0.0 107.793 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -54.18 -54.07 44.76 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 119.709 1.14 . . . . 0.0 111.393 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 47.5 t -67.19 -36.28 81.42 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.785 0.721 . . . . 0.0 111.103 -177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -61.7 -48.86 78.85 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.048 1.339 . . . . 0.0 109.402 176.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.68 -36.42 83.78 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.284 177.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -61.54 -55.55 29.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 175.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -56.01 -52.2 65.05 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 127.333 2.253 . . . . 0.0 111.5 -178.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.399 0 O-C-N 121.393 -0.817 . . . . 0.0 111.798 178.348 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.414 0 CA-C-O 123.203 1.478 . . . . 0.0 110.043 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.4 m -96.27 171.24 8.71 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 127.463 2.305 . . . . 0.0 105.597 175.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.4 tttp -138.85 -170.95 2.97 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 120.787 -1.196 . . . . 0.0 111.268 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -140.2 151.36 21.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 124.342 1.057 . . . . 0.0 111.193 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -95.44 79.05 3.42 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 101.37 -3.567 . . . . 0.0 101.37 174.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -58.63 -33.08 69.64 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 116.569 -1.681 . . . . 0.0 112.188 -175.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -73.54 -54.32 8.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 119.283 0.947 . . . . 0.0 109.199 -176.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.67 -35.5 76.4 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 119.529 -0.272 . . . . 0.0 111.011 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.6 m -76.74 -32.3 57.68 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 117.811 -1.09 . . . . 0.0 110.819 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.78 -37.96 77.46 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 116.326 -1.797 . . . . 0.0 108.621 177.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.7 -61.62 2.19 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 119.521 1.055 . . . . 0.0 108.966 -177.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.12 -33.82 75.22 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.612 -0.68 . . . . 0.0 111.236 -176.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -59.32 -38.59 80.66 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.417 0.687 . . . . 0.0 110.239 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -66.06 -45.06 82.67 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 124.636 1.175 . . . . 0.0 109.04 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -54.69 -57.52 11.17 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 118.716 0.689 . . . . 0.0 109.267 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.6 t -61.07 -24.07 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 123.085 0.554 . . . . 0.0 112.335 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 -45.03 15.52 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 121.177 -0.952 . . . . 0.0 109.474 175.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -51.53 123.33 9.64 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 126.66 1.984 . . . . 0.0 110.943 -175.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -73.41 -9.87 59.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.489 -176.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.46 -8.09 50.24 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-O 118.914 -0.937 . . . . 0.0 112.576 175.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.6 t -68.39 148.03 51.25 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 118.744 1.272 . . . . 0.0 111.176 -175.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.13 -36.03 19.82 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.051 -1.432 . . . . 0.0 107.185 174.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.7 t -68.91 123.89 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.91 -24.46 3.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 124.392 1.077 . . . . 0.0 110.642 177.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -121.59 142.45 50.09 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.866 1.266 . . . . 0.0 108.179 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.3 t -137.98 160.19 33.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 126.606 1.962 . . . . 0.0 106.652 176.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 76.9 p -126.75 156.87 40.5 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 175.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -129.83 130.94 45.92 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.0 mmmt -103.8 176.1 5.26 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -123.88 139.79 53.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 176.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -131.54 123.3 27.69 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 175.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 47.31 -100.85 0.03 OUTLIER Glycine 0 CA--C 1.525 0.691 0 C-N-CA 124.606 1.098 . . . . 0.0 112.105 -176.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.3 p -120.23 42.72 2.89 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.617 1.167 . . . . 0.0 111.91 177.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.2 t -152.83 160.69 43.1 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.799 1.181 . . . . 0.0 111.4 175.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 21.3 mm -90.79 136.33 24.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -131.63 163.58 48.75 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 124.493 1.117 . . . . 0.0 109.976 178.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.97 164.63 34.05 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.017 1.811 . . . . 0.0 111.242 175.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.1 -146.92 5.79 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 126.312 1.911 . . . . 0.0 108.856 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.81 161.12 26.89 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.878 1.271 . . . . 0.0 110.852 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.27 153.78 36.75 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.307 1.843 . . . . 0.0 110.266 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 174.5 -172.28 45.26 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-N 119.209 0.913 . . . . 0.0 113.279 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.69 -20.47 10.09 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 126.28 1.832 . . . . 0.0 113.002 -176.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -109.18 123.09 48.66 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 -176.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -82.35 -6.62 59.38 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.257 0.623 . . . . 0.0 112.49 -175.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -57.31 -29.29 63.8 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 120.83 -1.169 . . . . 0.0 112.7 177.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -74.6 -36.2 62.97 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.201 1.0 . . . . 0.0 111.239 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -56.76 -40.98 76.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 126.837 2.055 . . . . 0.0 109.087 -176.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.8 mm -55.57 -44.04 74.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 124.043 0.937 . . . . 0.0 108.583 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -85.43 -27.77 25.53 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.229 1.012 . . . . 0.0 111.988 -178.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -63.56 -27.26 69.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 118.323 -0.846 . . . . 0.0 111.259 176.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 75.4 m -60.8 120.45 10.14 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.252 2.1 p -83.96 158.94 21.37 Favored 'General case' 0 N--CA 1.437 -1.078 0 C-N-CA 125.339 1.455 . . . . 0.0 108.992 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -50.41 -73.77 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 126.668 1.987 . . . . 0.0 115.499 -175.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -105.83 -36.49 7.0 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.161 1.385 . . . . 0.0 113.703 -175.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.8 m -60.8 159.86 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.452 0.701 . . . . 0.0 111.857 -175.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.77 151.04 23.52 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.197 0.599 . . . . 0.0 109.443 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.8 tp -150.6 168.04 25.47 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.383 1.473 . . . . 0.0 108.494 -176.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -131.58 154.95 48.32 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.079 0.551 . . . . 0.0 109.688 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.462 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -147.36 167.52 24.12 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 123.453 0.701 . . . . 0.0 112.339 176.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -141.09 123.28 15.65 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.8 t -136.12 130.79 48.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.03 114.14 16.61 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 176.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -118.24 170.75 8.63 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 124.36 1.064 . . . . 0.0 108.641 -175.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 89.8 m . . . . . 0 N--CA 1.45 -0.465 0 O-C-N 120.451 -1.406 . . . . 0.0 110.558 -175.898 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.237 0.433 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.9 mtmt -61.46 160.08 11.67 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.4 0.619 . . . . 0.0 110.522 176.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 -123.48 158.74 30.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 175.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.1 t -146.16 137.39 24.6 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 175.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -140.34 123.89 17.08 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -87.89 141.17 28.8 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.5 114.72 23.88 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.085 1.354 . . . . 0.0 109.282 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.33 113.57 21.24 Favored 'General case' 0 C--O 1.225 -0.237 0 N-CA-C 103.664 -2.717 . . . . 0.0 103.664 175.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.2 mt -105.31 142.66 17.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 m -126.27 123.57 38.4 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 175.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.7 t-105 -90.29 123.44 34.06 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 103.798 -2.668 . . . . 0.0 103.798 175.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 4.7 mm -137.56 86.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 103.563 -2.754 . . . . 0.0 103.563 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.76 147.36 6.89 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -54.29 -21.82 10.28 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.897 0.702 . . . . 0.0 112.897 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -83.12 -34.76 26.01 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 117.321 -1.323 . . . . 0.0 112.078 -175.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.82 136.09 26.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 120.489 1.495 . . . . 0.0 109.88 -178.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.7 t -145.82 176.71 9.46 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 127.125 2.17 . . . . 0.0 107.396 -176.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.72 -156.81 53.52 Favored Glycine 0 N--CA 1.45 -0.405 0 CA-C-O 121.535 0.519 . . . . 0.0 112.148 175.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 tt -51.63 -36.78 47.39 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.799 1.24 . . . . 0.0 111.269 -176.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.4 mp0 -63.7 -35.68 81.35 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 119.565 1.075 . . . . 0.0 112.141 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -76.06 -49.72 16.71 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 175.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.22 -29.21 63.55 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.299 1.44 . . . . 0.0 113.296 -175.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -48.47 -37.74 18.19 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 119.778 1.172 . . . . 0.0 111.415 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 20.3 m -58.16 -32.28 68.04 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.889 0.768 . . . . 0.0 111.893 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.24 -25.97 72.46 Favored Glycine 0 CA--C 1.53 0.985 0 O-C-N 120.86 -1.15 . . . . 0.0 112.34 177.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.5 m -105.75 -16.69 14.6 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.489 1.915 . . . . 0.0 111.633 -176.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -103.95 -25.85 12.87 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 126.086 1.754 . . . . 0.0 112.073 -175.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 19.3 mtmt -56.67 -26.65 56.96 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.453 1.479 . . . . 0.0 112.311 175.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -62.3 -38.31 88.88 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 118.942 0.792 . . . . 0.0 109.84 176.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 39.6 mt -68.88 -61.41 1.81 Allowed 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 125.849 1.66 . . . . 0.0 109.576 -176.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.286 1.4 p -55.89 -30.87 29.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 118.052 -0.975 . . . . 0.0 108.514 176.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.55 -39.06 93.43 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 120.626 1.557 . . . . 0.0 109.617 175.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -54.95 -29.04 55.66 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 121.487 1.949 . . . . 0.0 111.701 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 79.7 t -86.1 -52.35 12.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 119.258 0.935 . . . . 0.0 109.227 175.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.2 t -79.21 14.82 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 129.432 3.093 . . . . 0.0 115.116 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -55.72 -26.21 44.17 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 122.381 2.355 . . . . 0.0 112.866 -176.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -84.85 63.7 8.19 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 175.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -137.47 176.4 8.74 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.674 0.789 . . . . 0.0 109.52 176.14 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.93 -66.38 1.0 Allowed 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 124.096 0.873 . . . . 0.0 110.216 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -148.26 176.21 10.44 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.818 1.647 . . . . 0.0 109.614 -176.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -121.37 171.94 8.4 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 125.021 1.328 . . . . 0.0 111.467 -177.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -145.61 147.98 32.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 17.2 t -126.32 125.68 67.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 175.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.3 mt -121.79 143.93 32.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 125.979 1.712 . . . . 0.0 109.214 -175.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.9 p -137.42 1.39 2.39 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -142.87 153.43 43.14 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -177.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -62.52 -38.74 91.14 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.719 0.69 . . . . 0.0 110.237 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -61.47 -45.28 94.94 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 119.091 0.859 . . . . 0.0 109.232 175.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -62.47 -23.94 67.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.813 1.245 . . . . 0.0 111.011 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -83.68 -23.86 31.54 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.074 1.75 . . . . 0.0 113.02 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -62.65 124.07 20.02 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.75 0.705 . . . . 0.0 112.127 -175.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.71 -26.07 66.88 Favored 'General case' 0 CA--C 1.527 0.077 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -56.7 -45.18 81.98 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -175.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -89.61 -24.42 21.68 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 117.961 -1.019 . . . . 0.0 109.102 178.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 24.8 mt -56.68 -40.92 72.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 N-CA-C 106.65 -1.611 . . . . 0.0 106.65 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.3 mtpm? -53.59 -52.46 59.72 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 118.593 0.633 . . . . 0.0 110.215 175.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 9.2 t -65.64 -37.94 87.96 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.468 0.707 . . . . 0.0 111.108 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -61.4 -53.88 50.82 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.85 1.66 . . . . 0.0 108.934 177.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 76.2 mt -62.0 -34.18 75.71 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 125.103 1.361 . . . . 0.0 110.098 175.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.03 -50.25 74.1 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 120.434 1.47 . . . . 0.0 110.643 175.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt -62.01 -49.65 75.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 120.352 1.433 . . . . 0.0 109.08 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.869 0 C-N-CA 124.227 1.011 . . . . 0.0 111.988 175.729 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.6 m -63.56 157.72 22.97 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.005 1.722 . . . . 0.0 106.644 176.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.96 -173.04 2.66 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 120.668 -1.27 . . . . 0.0 112.021 -175.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.66 149.26 29.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 124.005 0.922 . . . . 0.0 109.413 177.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -94.6 71.08 3.61 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 103.554 -2.758 . . . . 0.0 103.554 175.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -56.67 -34.09 67.03 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-O 117.909 -1.044 . . . . 0.0 111.517 -175.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -70.09 -38.67 75.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 119.828 1.194 . . . . 0.0 110.615 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.81 -49.32 18.41 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 121.827 -0.546 . . . . 0.0 110.057 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.3 m -62.1 -38.02 87.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.699 -0.626 . . . . 0.0 111.56 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -62.49 -31.59 72.37 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 116.289 -1.815 . . . . 0.0 110.327 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.38 -54.38 47.48 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 120.766 1.621 . . . . 0.0 110.727 178.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.59 -40.06 73.47 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.516 -0.74 . . . . 0.0 111.486 -178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -55.66 -43.01 75.9 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 118.406 -0.807 . . . . 0.0 109.683 176.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -57.54 -45.0 85.61 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.487 1.115 . . . . 0.0 111.043 -177.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mp -59.45 -63.04 1.44 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.324 0.65 . . . . 0.0 110.099 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.5 t -58.35 -30.56 40.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 123.108 0.563 . . . . 0.0 111.84 -176.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.24 -28.2 63.0 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.894 1.277 . . . . 0.0 111.342 175.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -71.18 155.73 40.4 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.682 0.673 . . . . 0.0 109.7 -174.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -86.43 -18.5 31.57 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.954 1.302 . . . . 0.0 113.297 177.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.29 -2.43 38.38 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 125.155 1.359 . . . . 0.0 114.586 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.3 t -69.66 135.34 49.77 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 119.574 1.687 . . . . 0.0 110.407 -178.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.74 -25.52 56.63 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 55.2 t -78.27 123.9 35.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 175.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.2 pp -112.66 -23.7 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.673 1.189 . . . . 0.0 111.155 -176.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 38.2 p-90 -130.05 153.69 48.19 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 122.013 0.911 . . . . 0.0 111.008 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.2 t -139.6 165.89 21.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 128.579 2.752 . . . . 0.0 108.622 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.465 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 30.9 p -126.0 160.86 28.92 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.487 1.115 . . . . 0.0 109.0 175.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -132.86 126.67 32.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.8 mmmt -109.44 171.5 7.41 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.421 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 49.6 m-85 -121.65 143.68 49.2 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 175.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -139.19 123.54 18.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 35.43 -98.98 0.01 OUTLIER Glycine 0 CA--C 1.532 1.099 0 C-N-CA 126.916 2.198 . . . . 0.0 115.068 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 m -104.4 18.3 22.43 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.253 1.421 . . . . 0.0 113.941 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.2 t -146.37 169.0 19.75 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 120.748 1.613 . . . . 0.0 114.166 -175.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.421 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 17.5 mm -99.21 132.96 43.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 104.39 -2.448 . . . . 0.0 104.39 175.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.3 m -126.16 154.96 74.34 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 175.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.75 162.87 36.85 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 CA-C-N 121.357 1.52 . . . . 0.0 109.565 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.5 -158.63 10.43 Favored Glycine 0 CA--C 1.523 0.575 0 C-N-CA 126.517 2.008 . . . . 0.0 108.69 175.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -60.23 167.59 2.35 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 122.073 0.939 . . . . 0.0 112.694 176.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -138.0 161.64 36.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.752 2.021 . . . . 0.0 110.271 -175.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.42 176.74 43.93 Favored Glycine 0 CA--C 1.527 0.785 0 CA-C-O 122.029 0.794 . . . . 0.0 113.346 178.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -125.77 -3.46 7.15 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.494 1.918 . . . . 0.0 112.042 -176.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.421 ' HG3' ' HD1' ' A' ' 50' ' ' HIS . 2.7 tp10 -131.22 127.78 38.6 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 127.27 2.228 . . . . 0.0 105.889 -175.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -83.17 -15.85 48.97 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 118.357 -0.83 . . . . 0.0 109.407 -175.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -55.82 -36.31 67.34 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 120.139 1.336 . . . . 0.0 109.595 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.421 ' HD1' ' HG3' ' A' ' 47' ' ' GLU . 64.4 m80 -65.63 -29.27 69.82 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 118.406 -0.806 . . . . 0.0 112.015 176.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -61.27 -51.67 67.93 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 124.42 1.088 . . . . 0.0 108.936 178.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.8 mp -62.75 -34.7 67.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 O-C-N 121.665 -0.647 . . . . 0.0 109.648 -175.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -73.92 -35.0 64.56 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.131 0.878 . . . . 0.0 111.226 176.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -61.93 -33.42 74.23 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.939 1.296 . . . . 0.0 112.893 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 89.9 m -50.64 121.49 5.89 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.077 0.951 . . . . 0.0 110.337 -176.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.674 ' HG1' ' CG2' ' A' ' 59' ' ' VAL . 2.0 p -84.15 170.69 13.55 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 128.532 2.733 . . . . 0.0 111.798 -176.03 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.484 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 10.2 p-10 -69.9 -76.87 0.09 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.942 2.097 . . . . 0.0 115.957 -174.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.484 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 3.2 t70 -106.51 -30.57 8.98 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 127.106 2.162 . . . . 0.0 112.402 -176.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.674 ' CG2' ' HG1' ' A' ' 56' ' ' THR . 1.5 m -55.18 156.24 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-O 122.966 1.365 . . . . 0.0 111.451 -175.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.0 123.81 48.72 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 176.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.5 tp -129.29 165.98 20.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.628 1.571 . . . . 0.0 109.317 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -132.01 152.25 51.25 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -138.01 155.05 49.24 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.009 1.324 . . . . 0.0 111.268 177.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -127.9 123.49 35.12 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.956 -2.239 . . . . 0.0 104.956 177.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.1 t -132.5 135.77 57.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -80.48 123.69 28.28 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 175.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -126.25 169.88 12.43 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.929 1.292 . . . . 0.0 108.029 -176.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.446 -0.628 0 O-C-N 120.162 -1.586 . . . . 0.0 108.683 -179.6 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -61.56 151.41 33.23 Favored 'General case' 0 C--N 1.339 0.136 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 177.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -137.47 161.97 34.92 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 103.796 -2.668 . . . . 0.0 103.796 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.1 t -142.05 149.14 39.55 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 176.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -131.15 172.38 12.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -141.69 139.67 33.0 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 177.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -116.47 117.58 30.3 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -176.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -91.47 113.64 25.96 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 102.138 -3.282 . . . . 0.0 102.138 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.3 mp -105.75 125.73 61.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -101.84 123.51 45.9 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 56.0 t-105 -95.33 123.41 38.84 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 104.729 -2.323 . . . . 0.0 104.729 175.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.3 mt -143.92 98.36 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 -179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -63.32 166.79 24.69 Favored Glycine 0 CA--C 1.534 1.226 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 175.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -77.97 -12.01 59.95 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.344 -1.68 . . . . 0.0 110.628 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -83.07 -27.43 30.27 Favored 'General case' 0 C--O 1.237 0.426 0 O-C-N 120.14 -1.6 . . . . 0.0 112.17 -175.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.3 p -67.43 123.85 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 104.75 -2.315 . . . . 0.0 104.75 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.7 t -66.23 158.73 28.13 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 122.203 1.001 . . . . 0.0 111.4 -175.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.92 -24.43 49.81 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.411 1.482 . . . . 0.0 113.196 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 9.8 tt -67.99 -50.79 53.5 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-N 119.354 1.577 . . . . 0.0 109.641 176.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -63.96 -43.65 95.16 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 176.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 42.3 ttp85 -55.09 -35.81 64.98 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 118.391 0.541 . . . . 0.0 111.249 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.63 -26.62 65.63 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 118.025 -0.988 . . . . 0.0 111.888 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -57.15 -39.47 75.27 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 121.115 1.78 . . . . 0.0 111.371 175.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 38.1 m -55.5 -28.22 53.31 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 119.948 1.249 . . . . 0.0 110.99 175.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.44 -20.58 67.84 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.409 1.481 . . . . 0.0 114.406 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 92.4 m -120.9 -6.96 9.55 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.909 1.284 . . . . 0.0 110.89 176.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -104.19 -24.96 13.1 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-O 118.247 -0.882 . . . . 0.0 113.169 -175.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -58.63 -24.04 60.28 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 121.248 1.84 . . . . 0.0 111.434 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -69.65 -41.25 75.82 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 120.197 1.362 . . . . 0.0 108.608 175.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 25.4 mt -57.5 -63.04 1.37 Allowed 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 126.193 1.797 . . . . 0.0 111.408 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.53 -29.65 42.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.059 176.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -72.14 -25.06 61.56 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-O 116.882 -1.532 . . . . 0.0 111.714 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -61.64 -38.53 88.03 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 122.061 2.209 . . . . 0.0 109.713 175.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 98.9 t -72.97 -60.37 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 175.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 39.3 t -77.79 26.45 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 129.153 2.981 . . . . 0.0 112.927 -175.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -57.19 -26.36 60.51 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 119.713 -1.867 . . . . 0.0 110.751 -177.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -84.3 72.49 10.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.92 1.288 . . . . 0.0 107.854 175.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -145.03 174.63 10.87 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 122.826 0.45 . . . . 0.0 110.878 176.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.35 -66.2 0.93 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 118.507 -0.759 . . . . 0.0 109.865 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.38 176.41 11.71 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.702 2.001 . . . . 0.0 108.721 178.095 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -106.4 173.5 6.29 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 123.568 0.747 . . . . 0.0 112.204 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -143.4 155.04 44.29 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 103.126 -2.916 . . . . 0.0 103.126 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 14.7 t -131.84 129.52 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 O-C-N 120.61 -1.306 . . . . 0.0 107.679 175.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -133.97 148.1 30.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 125.509 1.524 . . . . 0.0 107.835 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 7.7 p -130.85 -8.45 3.97 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.454 1.902 . . . . 0.0 113.966 -176.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -124.22 124.27 42.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -176.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.9 ttp85 -60.17 -30.56 69.41 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.316 -178.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -74.66 -26.18 59.69 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 119.83 1.195 . . . . 0.0 111.909 175.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.31 -40.54 43.95 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -177.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -45.18 -23.32 0.16 Allowed 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 130.195 3.398 . . . . 0.0 116.279 -175.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -48.15 130.54 15.88 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 125.476 1.51 . . . . 0.0 111.782 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -56.12 -16.48 5.19 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 176.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.262 30.2 t70 -58.1 -56.42 22.31 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 117.565 -1.207 . . . . 0.0 112.988 -175.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -77.09 -26.36 53.32 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 116.459 -2.096 . . . . 0.0 107.608 -175.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 51.4 mt -55.72 -40.84 62.77 Favored 'Isoleucine or valine' 0 C--N 1.343 0.302 0 C-N-CA 124.836 1.254 . . . . 0.0 108.331 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.2 mtmm -54.35 -52.17 62.43 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.915 0.779 . . . . 0.0 110.438 175.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 47.5 t -63.93 -44.25 93.43 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 117.962 -1.018 . . . . 0.0 109.47 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -63.85 -40.54 96.82 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.731 1.605 . . . . 0.0 110.687 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.44 -32.68 74.42 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.754 0.821 . . . . 0.0 109.358 175.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 46.3 mmtt -76.31 -38.53 55.9 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.412 1.485 . . . . 0.0 112.083 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -59.86 -57.24 13.73 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 125.998 1.719 . . . . 0.0 106.79 175.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.501 0 C-N-CA 123.461 0.705 . . . . 0.0 112.582 175.86 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 121.85 0.833 . . . . 0.0 111.533 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.8 m -111.9 171.92 7.21 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 128.06 2.544 . . . . 0.0 106.298 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.7 mmtp -140.48 178.99 6.92 Favored 'General case' 0 CA--C 1.513 -0.446 0 O-C-N 121.219 -0.926 . . . . 0.0 111.332 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -126.23 150.49 31.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 124.58 1.152 . . . . 0.0 109.441 179.243 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -95.05 83.42 3.93 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 101.759 -3.423 . . . . 0.0 101.759 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -61.99 -29.36 70.2 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 117.324 -1.322 . . . . 0.0 112.93 -175.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -69.09 -59.22 3.18 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.629 1.104 . . . . 0.0 108.346 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.62 95.68 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 122.667 0.387 . . . . 0.0 111.276 -176.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 85.7 m -73.97 -33.21 63.79 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.56 -0.733 . . . . 0.0 110.781 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.7 ttt-85 -63.92 -37.1 86.17 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 116.979 -1.486 . . . . 0.0 108.53 175.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.75 -46.91 87.71 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 120.351 1.432 . . . . 0.0 110.679 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.26 -50.78 71.67 Favored 'General case' 0 N--CA 1.462 0.137 0 O-C-N 121.553 -0.717 . . . . 0.0 111.523 176.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -51.39 -47.53 62.87 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.581 0.752 . . . . 0.0 110.293 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.89 -49.55 77.24 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.417 1.887 . . . . 0.0 111.0 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mp -59.52 -51.14 71.14 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 120.275 1.398 . . . . 0.0 111.205 175.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.93 -30.4 47.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 O-C-N 121.741 -0.599 . . . . 0.0 110.033 -178.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.15 -38.74 60.87 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.375 1.07 . . . . 0.0 112.973 175.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -67.46 123.36 20.18 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -175.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.67 -32.16 68.85 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 124.666 1.186 . . . . 0.0 112.205 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.0 -11.47 82.51 Favored Glycine 0 CA--C 1.526 0.757 0 CA-C-O 119.374 -0.681 . . . . 0.0 112.45 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.0 t -81.19 123.62 28.6 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 118.961 1.381 . . . . 0.0 107.552 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.48 -23.89 62.77 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.608 175.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 t -67.23 123.69 20.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -108.32 -23.78 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 C-N-CA 124.315 1.046 . . . . 0.0 110.06 178.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -131.05 138.99 49.86 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.802 0.841 . . . . 0.0 110.502 -179.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 62.0 t -136.34 149.96 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.432 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 23.3 p -104.34 159.76 15.45 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 176.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -124.45 123.82 40.97 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 175.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -98.45 175.78 5.91 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 176.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -127.03 124.05 38.45 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 106.781 -1.562 . . . . 0.0 106.781 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -112.69 123.42 50.27 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 104.261 -2.496 . . . . 0.0 104.261 175.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 23.04 -88.86 0.01 OUTLIER Glycine 0 CA--C 1.529 0.961 0 C-N-CA 127.661 2.553 . . . . 0.0 116.683 -176.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 65.0 p -92.66 2.22 56.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.059 2.143 . . . . 0.0 116.175 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -150.63 175.83 11.57 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.233 1.379 . . . . 0.0 114.647 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 11.6 mm -93.69 136.26 25.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 128.036 2.534 . . . . 0.0 106.256 175.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.8 m -135.31 159.36 72.09 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-O 118.475 -0.774 . . . . 0.0 110.561 176.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.12 155.46 47.24 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 121.753 1.635 . . . . 0.0 110.288 175.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -120.45 -152.86 9.0 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 126.668 2.08 . . . . 0.0 109.728 176.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.42 164.97 5.11 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.491 1.117 . . . . 0.0 110.736 176.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -145.03 162.29 37.31 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.252 1.421 . . . . 0.0 110.127 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.72 176.7 42.91 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-O 122.055 0.809 . . . . 0.0 112.512 -179.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -125.46 -6.07 7.04 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.049 1.739 . . . . 0.0 111.965 -176.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.23 141.9 43.99 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 -177.17 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -83.89 -14.52 50.87 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -174.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -60.56 -36.11 77.68 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 119.885 -1.76 . . . . 0.0 109.564 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -71.7 -22.76 61.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.323 1.049 . . . . 0.0 112.034 175.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -67.09 -43.57 82.2 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.339 1.056 . . . . 0.0 109.522 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.0 mm -54.32 -47.24 69.3 Favored 'Isoleucine or valine' 0 C--N 1.342 0.245 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -176.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.3 mm-40 -65.03 -23.93 67.34 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.53 0.732 . . . . 0.0 112.502 -176.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -77.39 -24.26 50.56 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 119.444 1.02 . . . . 0.0 111.359 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.2 m -73.83 113.62 11.19 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.07 -1.455 . . . . 0.0 107.07 177.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.31 2.1 p -100.73 178.39 4.72 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.892 1.277 . . . . 0.0 110.594 -176.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.09 -76.15 0.1 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 117.951 2.574 . . . . 0.0 117.951 -174.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.39 -27.8 19.09 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 120.226 1.375 . . . . 0.0 114.569 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.7 m -70.63 169.66 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 120.895 -1.128 . . . . 0.0 112.165 -175.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.3 144.77 48.45 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.805 1.242 . . . . 0.0 107.986 178.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.9 tp -146.79 166.63 26.06 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.058 1.743 . . . . 0.0 107.702 -176.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -133.08 157.82 44.31 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 176.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.432 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.71 153.51 41.06 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 118.744 0.702 . . . . 0.0 111.139 175.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -119.86 123.64 44.12 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 104.536 -2.394 . . . . 0.0 104.536 175.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 39.3 t -135.15 138.72 48.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 O-C-N 123.222 0.326 . . . . 0.0 110.209 -175.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.7 ttm180 -75.41 117.85 17.65 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.639 1.976 . . . . 0.0 106.949 175.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -131.88 150.92 52.01 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 84.7 m . . . . . 0 N--CA 1.453 -0.308 0 O-C-N 121.517 -0.74 . . . . 0.0 111.153 -175.668 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.2 m . . . . . 0 N--CA 1.447 -0.582 0 CA-C-O 121.466 0.65 . . . . 0.0 109.845 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -55.78 143.35 31.34 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.379 0.671 . . . . 0.0 109.585 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -119.38 162.46 18.76 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 t -139.55 151.73 46.32 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.3 mttp -146.39 175.81 10.26 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.686 1.995 . . . . 0.0 107.076 176.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -140.26 134.69 31.4 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 175.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -104.83 114.26 28.36 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 124.877 1.361 . . . . 0.0 107.401 177.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -83.47 113.53 20.84 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 102.339 -3.208 . . . . 0.0 102.339 175.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 mt -96.75 142.66 13.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 -176.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.3 m -125.59 123.46 39.08 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 104.382 -2.451 . . . . 0.0 104.382 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 39.5 t-105 -103.06 124.28 48.24 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 104.825 -2.287 . . . . 0.0 104.825 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 mm -125.54 110.06 23.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 103.562 -2.755 . . . . 0.0 103.562 175.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -54.96 126.8 39.54 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 107.643 -2.183 . . . . 0.0 107.643 175.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.53 -12.25 2.58 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 118.786 1.293 . . . . 0.0 112.833 -175.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -83.77 -30.68 26.43 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 117.324 -1.322 . . . . 0.0 111.401 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.14 143.82 13.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 121.083 1.765 . . . . 0.0 111.392 -175.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.0 t -143.16 176.69 8.93 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.463 1.905 . . . . 0.0 106.938 175.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 79.58 -156.32 40.65 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 176.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.0 tt -59.27 -42.52 91.41 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.404 1.081 . . . . 0.0 112.535 -175.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -33.62 73.86 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 120.706 1.594 . . . . 0.0 111.536 -176.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.31 -50.33 27.83 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 175.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.34 -27.02 67.03 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 125.17 1.388 . . . . 0.0 113.41 -176.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -46.26 -41.32 12.85 Favored 'General case' 0 CA--C 1.502 -0.889 0 C-N-CA 124.489 1.116 . . . . 0.0 110.205 175.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.2 m -52.79 -39.6 62.47 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.422 1.089 . . . . 0.0 111.144 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -74.86 -10.31 83.59 Favored Glycine 0 CA--C 1.532 1.146 0 O-C-N 121.351 -0.843 . . . . 0.0 113.612 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 47.2 m -112.46 -15.14 13.15 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.358 1.863 . . . . 0.0 110.763 177.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -104.31 -29.33 10.85 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 126.504 1.921 . . . . 0.0 112.898 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -54.41 -33.04 58.59 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 119.901 1.228 . . . . 0.0 112.885 177.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.8 t -63.95 -34.19 77.43 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 118.842 0.746 . . . . 0.0 111.412 176.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 30.8 mt -67.76 -61.82 1.7 Allowed 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 125.678 1.591 . . . . 0.0 109.478 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -58.67 -33.33 48.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-O 118.147 -0.93 . . . . 0.0 109.173 175.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 63.0 tttt -64.92 -42.07 95.03 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 120.481 1.491 . . . . 0.0 110.232 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.78 -26.06 61.4 Favored 'General case' 0 C--N 1.335 -0.048 0 CA-C-N 119.146 0.885 . . . . 0.0 111.952 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 69.7 t -84.27 -61.74 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 175.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.05 26.53 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 129.843 3.257 . . . . 0.0 113.448 -175.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -50.54 -26.78 5.61 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 119.895 -1.753 . . . . 0.0 112.491 -176.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -88.75 74.49 8.33 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 175.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -140.04 161.0 38.66 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 175.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -87.49 -66.83 0.87 Allowed 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.201 -176.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.99 176.34 12.32 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 129.615 3.166 . . . . 0.0 108.698 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -119.89 165.73 14.24 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.345 1.058 . . . . 0.0 112.74 -175.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -133.94 147.31 51.05 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 104.311 -2.478 . . . . 0.0 104.311 -175.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.8 t -123.14 129.52 74.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 176.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -132.9 141.14 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 125.26 1.424 . . . . 0.0 107.752 -176.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 p -139.38 -2.26 1.63 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 175.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -129.07 151.35 49.85 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 124.512 1.125 . . . . 0.0 110.182 178.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 40.8 ttp-105 -58.19 -45.43 87.59 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 123.103 0.561 . . . . 0.0 110.881 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -65.66 -23.48 66.8 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.65 0.659 . . . . 0.0 110.539 -176.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -83.37 -23.25 32.53 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.9 2.08 . . . . 0.0 110.986 175.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -77.35 -23.29 50.9 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.692 1.597 . . . . 0.0 112.536 178.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 -63.4 123.78 19.59 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -175.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -49.69 -25.25 2.77 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 119.28 3.067 . . . . 0.0 119.28 175.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -63.33 -56.26 17.83 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 119.335 0.971 . . . . 0.0 113.154 -175.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -78.37 -26.09 46.52 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 118.0 -1.48 . . . . 0.0 109.152 -177.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 19.4 mt -52.7 -40.5 34.81 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 C-N-CA 124.899 1.28 . . . . 0.0 108.926 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 33.8 mttp -54.8 -49.49 70.84 Favored 'General case' 0 N--CA 1.457 -0.075 0 CA-C-N 118.213 0.46 . . . . 0.0 111.766 176.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 35.1 t -72.0 -36.31 69.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.059 0.544 . . . . 0.0 111.379 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.15 -46.03 91.05 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 119.466 1.03 . . . . 0.0 108.603 176.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 74.1 mt -66.6 -23.92 66.25 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 123.849 0.86 . . . . 0.0 110.883 175.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 16.1 mttt -73.0 -47.81 41.88 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 120.413 1.461 . . . . 0.0 107.182 175.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -61.44 -60.78 3.19 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.716 0.806 . . . . 0.0 109.036 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.527 0 C-N-CA 125.087 1.355 . . . . 0.0 112.124 175.824 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.307 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.9 m -142.99 158.27 43.76 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.608 1.563 . . . . 0.0 106.962 -175.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -132.66 -171.73 2.73 Favored 'General case' 0 CA--C 1.518 -0.282 0 O-C-N 121.273 -0.892 . . . . 0.0 111.92 -175.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.9 152.9 33.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 C-N-CA 124.388 1.075 . . . . 0.0 110.913 176.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -99.78 85.0 3.0 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 100.601 -3.851 . . . . 0.0 100.601 174.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -61.24 -24.3 66.27 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 117.166 -1.397 . . . . 0.0 112.54 -175.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -76.95 -54.18 6.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 120.786 1.63 . . . . 0.0 109.205 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.11 -36.33 83.23 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.768 -0.583 . . . . 0.0 111.043 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 79.5 m -75.56 -38.84 58.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 118.966 -0.54 . . . . 0.0 111.526 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.7 ttt-85 -60.06 -34.53 73.55 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-O 116.789 -1.577 . . . . 0.0 109.024 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.87 -56.6 18.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 120.596 1.544 . . . . 0.0 110.509 -177.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.42 -43.69 98.44 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 118.507 0.594 . . . . 0.0 111.751 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -55.24 -44.19 75.27 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -59.51 -41.95 91.11 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.327 1.451 . . . . 0.0 111.105 -176.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.37 -60.99 2.77 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 123.984 0.802 . . . . 0.0 109.88 175.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.06 -31.64 46.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 122.978 0.511 . . . . 0.0 111.58 -175.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -37.25 86.92 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 125.872 1.669 . . . . 0.0 110.769 176.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -81.59 123.21 28.48 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 124.013 0.821 . . . . 0.0 109.68 -176.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.13 -17.87 64.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 118.596 -0.716 . . . . 0.0 112.884 175.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.28 -12.44 80.67 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.737 1.16 . . . . 0.0 113.061 176.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.1 t -80.06 137.9 36.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 119.559 1.68 . . . . 0.0 109.038 -177.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -74.34 -18.59 60.67 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.233 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.0 t -82.45 123.83 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 106.495 -1.668 . . . . 0.0 106.495 176.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -113.64 -23.65 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.66 -178.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 26.5 p-90 -129.48 135.49 48.7 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.636 0.774 . . . . 0.0 109.19 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 33.4 t -136.03 166.34 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 175.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 65.1 p -123.55 161.67 24.48 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.946 0.898 . . . . 0.0 109.757 175.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -128.18 123.7 34.98 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 175.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -95.21 176.16 6.33 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 178.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -122.53 140.35 52.87 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -142.12 143.46 33.03 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.728 1.611 . . . . 0.0 107.219 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 36.62 -104.69 0.03 OUTLIER Glycine 0 CA--C 1.528 0.857 0 C-N-CA 126.281 1.896 . . . . 0.0 113.55 -177.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.7 p -125.08 33.53 5.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.629 1.572 . . . . 0.0 111.224 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.2 t -142.78 175.85 9.51 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 122.022 0.915 . . . . 0.0 111.812 176.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.5 mm -102.92 137.96 29.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 126.035 1.734 . . . . 0.0 106.432 177.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.13 165.28 33.4 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 123.78 0.832 . . . . 0.0 109.583 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.78 168.33 24.86 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 121.842 1.695 . . . . 0.0 111.607 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.24 -170.74 12.08 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 126.495 1.998 . . . . 0.0 109.472 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -61.33 161.8 8.65 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.105 1.362 . . . . 0.0 111.215 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -145.13 174.11 11.34 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.06 1.344 . . . . 0.0 111.336 -178.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.39 -175.92 42.35 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 124.074 0.845 . . . . 0.0 111.568 177.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.96 -26.61 6.82 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 125.941 1.696 . . . . 0.0 110.134 175.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -108.15 130.47 55.12 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -82.96 -10.3 58.86 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -174.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 42.1 tt0 -54.09 -39.34 66.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 120.746 1.612 . . . . 0.0 111.156 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -56.93 -38.6 73.11 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.929 1.292 . . . . 0.0 111.769 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -59.0 -37.62 77.3 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.743 1.217 . . . . 0.0 108.525 -177.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.8 mm -61.96 -49.76 82.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -175.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -66.72 -32.42 73.71 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.52 0.6 . . . . 0.0 111.817 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -60.83 -38.89 87.01 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-O 118.786 -0.626 . . . . 0.0 111.192 -176.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.3 m -57.75 118.68 5.54 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.049 0.94 . . . . 0.0 110.442 -176.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 p -83.92 -173.9 4.98 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 129.28 3.032 . . . . 0.0 111.943 -176.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.405 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 19.9 p-10 -78.34 -70.29 0.5 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.112 0.965 . . . . 0.0 111.553 176.171 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.405 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 10.1 t70 -106.24 -36.34 6.9 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.378 1.871 . . . . 0.0 113.807 -175.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.5 m -60.41 129.86 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -175.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.82 141.95 35.23 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.289 1.835 . . . . 0.0 106.19 -175.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 tp -142.5 169.36 17.71 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.56 1.144 . . . . 0.0 110.892 -174.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -124.43 143.57 50.55 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.437 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -128.0 147.72 50.51 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 125.723 1.609 . . . . 0.0 110.331 176.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -121.31 124.06 43.67 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 104.394 -2.447 . . . . 0.0 104.394 177.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.5 t -136.8 143.6 34.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 O-C-N 123.358 0.411 . . . . 0.0 110.804 -175.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.3 119.04 25.23 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.315 1.446 . . . . 0.0 107.517 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -136.39 126.93 26.92 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.451 1.1 . . . . 0.0 109.048 -176.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.5 m . . . . . 0 C--N 1.325 -0.472 0 C-N-CA 124.591 1.157 . . . . 0.0 110.169 -175.711 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.45 -0.465 0 CA-C-O 121.338 0.59 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -71.34 149.29 46.22 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 105.353 -2.092 . . . . 0.0 105.353 175.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -133.63 154.56 50.81 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 175.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.2 t -145.09 128.76 17.17 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -135.3 175.7 9.34 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -138.89 141.21 38.57 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.291 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -115.87 134.18 55.26 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 125.899 1.68 . . . . 0.0 107.438 -178.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -102.92 113.57 27.12 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 175.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mp -107.13 138.73 31.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 -175.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.3 m -121.32 123.47 42.24 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 104.766 -2.309 . . . . 0.0 104.766 -177.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -93.02 123.35 36.21 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 176.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.9 mm -145.45 85.46 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.25 153.91 16.64 Favored Glycine 0 CA--C 1.532 1.136 0 O-C-N 121.551 -0.718 . . . . 0.0 112.205 -175.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -61.57 -19.44 62.17 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.565 -1.55 . . . . 0.0 112.132 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -83.36 -13.59 54.65 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 121.103 -0.998 . . . . 0.0 111.715 -176.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 12.7 p -72.64 131.93 34.12 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-N 120.001 1.273 . . . . 0.0 110.007 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.8 t -60.14 149.46 32.66 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.95 0.9 . . . . 0.0 109.367 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.53 -26.5 59.75 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.2 tt -68.89 -51.11 43.59 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 119.201 1.5 . . . . 0.0 110.668 177.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 19.9 mp0 -60.99 -38.82 87.35 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.315 -0.866 . . . . 0.0 109.5 175.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -61.62 -32.5 72.64 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.753 0.821 . . . . 0.0 111.248 175.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.79 -23.87 67.38 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.394 177.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.46 -54.05 50.24 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.913 1.688 . . . . 0.0 107.885 175.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 58.6 m -51.99 -38.22 55.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.864 0.866 . . . . 0.0 108.892 175.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -57.89 -19.87 38.67 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.067 1.318 . . . . 0.0 115.413 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 10.8 m -119.15 -2.94 10.64 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.816 1.808 . . . . 0.0 111.283 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -103.03 -23.7 13.67 Favored 'General case' 0 CA--C 1.516 -0.334 0 O-C-N 121.107 -0.995 . . . . 0.0 112.897 -175.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -49.77 -39.23 37.26 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.495 1.498 . . . . 0.0 112.604 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.8 t -59.87 -30.48 69.02 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.368 0.531 . . . . 0.0 111.753 -179.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.4 mt -64.47 -63.36 1.15 Allowed 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 124.562 1.145 . . . . 0.0 109.014 -178.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.251 0.9 OUTLIER -59.29 -29.38 41.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 118.603 -0.713 . . . . 0.0 109.655 175.83 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -63.32 -47.25 83.01 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 120.104 1.32 . . . . 0.0 109.017 175.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -52.42 -30.67 30.56 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.103 1.361 . . . . 0.0 111.92 -178.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 91.9 t -84.02 -54.41 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.054 0.942 . . . . 0.0 109.682 176.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 47.6 t -86.32 26.12 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 127.39 2.276 . . . . 0.0 114.081 -175.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -53.1 -26.55 16.78 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 119.749 -1.844 . . . . 0.0 114.752 -175.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -91.4 83.52 5.45 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -145.65 175.4 10.4 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 126.135 1.774 . . . . 0.0 107.759 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -101.95 -66.21 0.94 Allowed 'General case' 0 C--O 1.234 0.275 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -175.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -144.35 172.52 12.82 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 125.043 1.337 . . . . 0.0 109.598 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -126.59 168.37 14.4 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.159 0.984 . . . . 0.0 110.647 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -148.44 157.59 43.57 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 105.302 -2.11 . . . . 0.0 105.302 -175.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.4 t -131.8 124.19 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -123.92 141.53 43.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -179.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.3 p -129.26 3.2 5.17 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.517 1.127 . . . . 0.0 113.726 -176.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -137.73 124.56 21.2 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.693 1.197 . . . . 0.0 108.363 -175.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -64.56 -25.02 67.8 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.842 0.857 . . . . 0.0 112.189 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 32.6 mtmt -74.24 -47.32 35.98 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 119.973 1.261 . . . . 0.0 108.438 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -59.84 -39.17 84.22 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.622 -0.704 . . . . 0.0 111.662 178.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -44.04 -23.19 0.08 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 130.768 3.627 . . . . 0.0 115.554 -175.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -46.42 135.79 7.94 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 126.095 1.758 . . . . 0.0 109.68 175.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -63.87 -14.06 50.21 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 121.569 -0.707 . . . . 0.0 112.653 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -57.8 -55.32 36.44 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 119.168 0.895 . . . . 0.0 110.446 -176.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.33 -26.68 60.3 Favored 'General case' 0 C--N 1.351 0.657 0 C-N-CA 115.488 -2.485 . . . . 0.0 109.383 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 69.4 mt -60.41 -46.02 95.81 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -56.79 -52.69 64.05 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.31 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 34.1 t -61.85 -41.81 98.27 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.737 0.698 . . . . 0.0 110.335 -177.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -62.95 -51.31 67.38 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 123.668 0.787 . . . . 0.0 109.749 177.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 98.0 mt -63.7 -31.5 72.69 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.289 -1.507 . . . . 0.0 111.628 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -47.98 75.66 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.515 1.526 . . . . 0.0 107.953 175.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 46.9 mttm -62.02 -41.59 98.25 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.821 0.848 . . . . 0.0 109.234 175.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.219 0 C-N-CA 125.818 1.647 . . . . 0.0 112.98 -176.299 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.638 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m -135.81 168.89 18.46 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 175.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -133.86 -178.31 4.96 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.556 -1.34 . . . . 0.0 112.662 -178.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.24 151.37 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 124.498 1.119 . . . . 0.0 108.933 178.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -93.61 77.41 4.34 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 101.881 -3.377 . . . . 0.0 101.881 174.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.77 -24.45 65.77 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.966 -1.016 . . . . 0.0 112.85 -175.161 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -70.24 -56.48 6.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 119.641 1.11 . . . . 0.0 109.128 -175.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.52 86.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.56 0.344 . . . . 0.0 110.488 176.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.1 m -64.99 -36.09 83.28 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.727 -0.608 . . . . 0.0 111.501 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -61.24 -35.0 76.04 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 117.461 -1.257 . . . . 0.0 110.092 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.55 -53.21 59.35 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 120.248 1.385 . . . . 0.0 110.541 -178.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.63 -41.02 96.44 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.752 0.706 . . . . 0.0 111.261 178.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -56.79 -39.08 73.46 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.268 1.027 . . . . 0.0 110.057 177.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -66.67 -46.32 76.05 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 126.141 1.776 . . . . 0.0 110.785 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.5 mp -58.62 -52.76 64.3 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 118.784 0.72 . . . . 0.0 112.001 175.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 31.5 t -63.52 -36.51 76.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 118.777 0.717 . . . . 0.0 110.603 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.4 ttm-85 -63.7 -37.52 87.66 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 118.817 -0.611 . . . . 0.0 110.308 175.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -75.44 141.09 43.23 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.28 1.032 . . . . 0.0 113.189 -175.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -86.33 -11.85 50.99 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 126.448 1.899 . . . . 0.0 112.87 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -88.14 -35.8 8.67 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.0 t -54.39 138.45 39.69 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.892 1.677 . . . . 0.0 108.74 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.6 -35.52 60.52 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 175.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.8 t -63.08 127.22 22.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 C-N-CA 125.971 1.709 . . . . 0.0 109.99 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.5 pp -114.96 -23.83 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 126.489 1.916 . . . . 0.0 111.874 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 42.6 p-90 -126.27 148.86 49.42 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 119.577 1.08 . . . . 0.0 109.015 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.4 t -140.02 161.35 26.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 127.356 2.262 . . . . 0.0 106.682 176.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 17.2 p -124.07 156.73 36.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -132.5 124.7 29.02 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -110.32 176.47 5.04 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 -176.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.434 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 36.0 m-85 -123.28 136.5 54.72 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -176.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -148.76 124.03 10.21 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 175.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 54.95 -128.59 43.83 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 p -86.73 9.78 17.84 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.8 t -143.56 171.77 13.71 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 120.228 1.376 . . . . 0.0 114.604 -175.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.434 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 51.0 mm -90.76 137.13 22.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 101.826 -3.398 . . . . 0.0 101.826 174.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.1 m -121.83 158.95 53.17 Favored Pre-proline 0 C--O 1.236 0.376 0 C-N-CA 123.521 0.728 . . . . 0.0 110.132 176.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.19 154.61 61.82 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 121.167 1.245 . . . . 0.0 110.139 175.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.83 -171.31 15.0 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 127.295 2.379 . . . . 0.0 109.213 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -64.67 167.51 7.22 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 122.186 -0.597 . . . . 0.0 110.407 175.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -149.69 162.14 40.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.998 1.319 . . . . 0.0 109.02 -177.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.36 177.37 48.3 Favored Glycine 0 CA--C 1.524 0.615 0 CA-C-N 117.999 0.363 . . . . 0.0 112.227 -176.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.94 -7.23 17.1 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.222 1.409 . . . . 0.0 113.726 -175.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.6 137.93 45.71 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.737 1.215 . . . . 0.0 108.913 -175.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -84.54 -10.84 57.06 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 -175.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -61.45 -42.85 99.4 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 119.85 -1.781 . . . . 0.0 111.894 -176.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 75.4 m80 -68.96 -22.71 64.1 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.016 0.825 . . . . 0.0 111.393 178.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -61.83 -31.43 71.67 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 120.658 -1.277 . . . . 0.0 111.75 177.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.4 mm -62.03 -34.42 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -82.9 -32.64 27.21 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 117.834 -1.079 . . . . 0.0 110.099 175.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -53.82 -42.86 68.87 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 120.007 1.276 . . . . 0.0 111.081 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 76.5 m -60.89 113.42 2.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.3 p -83.62 176.93 8.65 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.466 1.506 . . . . 0.0 110.915 -176.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -72.19 -58.24 3.58 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 117.813 2.523 . . . . 0.0 117.813 -175.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -106.2 -35.51 7.17 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 117.181 2.289 . . . . 0.0 117.181 -174.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.7 m -67.77 173.37 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 123.007 1.384 . . . . 0.0 112.213 -175.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.8 ptt-85 -111.35 135.97 51.14 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 175.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.2 tp -134.48 162.15 33.05 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -131.99 147.23 52.44 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -139.38 126.97 21.75 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.37 0.668 . . . . 0.0 110.665 -178.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -95.65 123.36 39.17 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 101.933 -3.358 . . . . 0.0 101.933 175.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.2 t -135.09 136.17 51.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -175.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.482 ' NH1' ' HG ' ' A' ' 77' ' ' SER . 15.2 ttm-85 -75.71 130.49 38.77 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.86 1.664 . . . . 0.0 106.853 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -136.28 157.92 45.66 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.251 1.02 . . . . 0.0 109.407 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.0 m . . . . . 0 CA--C 1.533 0.295 0 O-C-N 120.77 -1.206 . . . . 0.0 109.973 -176.116 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.446 -0.674 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.5 mmtt -71.13 164.93 24.64 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 175.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.3 mtp180 -131.59 168.62 17.38 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 -177.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.482 ' HG ' ' NH1' ' A' ' 66' ' ' ARG . 6.8 t -145.4 132.93 20.82 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.162 -1.422 . . . . 0.0 107.162 175.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp -123.48 176.08 6.39 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.761 2.024 . . . . 0.0 107.49 -177.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -141.89 143.73 33.46 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 176.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -119.91 133.32 55.61 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 177.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -97.71 113.12 24.81 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 175.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mp -99.38 144.0 12.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -125.32 123.6 39.77 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 104.737 -2.32 . . . . 0.0 104.737 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.1 t-105 -100.68 131.89 46.35 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 175.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.0 mt -136.27 108.92 8.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 175.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.97 134.65 22.33 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 175.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.81 -7.01 9.42 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.179 -1.189 . . . . 0.0 113.112 -175.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -83.65 -23.63 31.72 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 120.188 -1.57 . . . . 0.0 112.96 176.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 14.2 p -85.82 123.02 39.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 120.921 1.691 . . . . 0.0 110.974 -175.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 25.3 t -146.67 124.14 11.7 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 175.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.72 -167.17 27.2 Favored Glycine 0 C--O 1.24 0.494 0 N-CA-C 107.562 -2.215 . . . . 0.0 107.562 -175.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.0 tt -53.68 -39.36 65.07 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 117.915 0.857 . . . . 0.0 109.899 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -57.03 -36.22 70.21 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.389 0.995 . . . . 0.0 111.248 -176.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.25 -49.58 27.0 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.18 -24.04 51.7 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.525 1.13 . . . . 0.0 112.844 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -50.24 -45.01 53.68 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 124.764 1.225 . . . . 0.0 109.384 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.4 m -55.09 -39.13 68.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 118.891 0.769 . . . . 0.0 110.886 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.05 -26.12 74.14 Favored Glycine 0 CA--C 1.526 0.737 0 CA-C-N 119.164 0.893 . . . . 0.0 112.717 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 99.7 m -94.48 -17.92 21.97 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.995 1.718 . . . . 0.0 111.223 177.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -104.25 -23.56 13.22 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 126.201 1.8 . . . . 0.0 115.178 -174.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -52.46 -27.86 17.85 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 120.817 1.644 . . . . 0.0 113.902 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -62.64 -43.78 97.94 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.827 1.194 . . . . 0.0 109.404 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 18.7 mt -55.2 -65.3 0.61 Allowed 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 125.774 1.63 . . . . 0.0 110.758 -175.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.288 0.8 OUTLIER -58.88 -28.67 38.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.564 176.196 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.8 tttm -69.24 -35.37 76.07 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 121.017 1.735 . . . . 0.0 110.312 175.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -57.71 -28.91 64.27 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 120.327 1.421 . . . . 0.0 110.366 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 89.3 t -79.97 -64.44 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 175.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 86.8 t -67.06 25.35 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 130.069 3.348 . . . . 0.0 114.431 -175.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -55.35 -26.6 41.92 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 118.884 -2.385 . . . . 0.0 115.217 -175.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -92.65 83.71 4.92 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 175.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -147.03 166.14 27.74 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.119 0.485 . . . . 0.0 109.702 175.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.72 -66.49 0.92 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.922 1.289 . . . . 0.0 110.04 -175.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -145.97 176.31 9.79 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 127.903 2.481 . . . . 0.0 109.592 175.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -117.14 167.48 11.15 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.693 1.197 . . . . 0.0 110.789 177.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -146.51 148.68 32.46 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -175.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 48.2 t -126.95 127.06 69.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 175.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mp -129.44 142.56 43.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 N-CA-C 106.348 -1.723 . . . . 0.0 106.348 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 p -130.08 -0.75 4.66 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.414 ' OD1' ' HE3' ' A' ' 121' ' ' LYS . 31.4 t0 -118.78 124.14 46.53 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.227 0.921 . . . . 0.0 109.267 176.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -65.63 -24.33 67.02 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.802 0.841 . . . . 0.0 111.189 -176.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.414 ' HE3' ' OD1' ' A' ' 119' ' ' ASP . 24.2 mtmt -76.45 -32.5 58.45 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.087 1.355 . . . . 0.0 110.017 175.206 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.61 -35.17 45.99 Favored 'General case' 0 C--O 1.215 -0.742 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -44.5 -23.14 0.1 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 131.173 3.789 . . . . 0.0 114.993 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -45.64 140.35 3.41 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.616 1.966 . . . . 0.0 110.374 175.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -64.76 -14.65 59.7 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.384 -0.823 . . . . 0.0 111.981 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -54.13 -52.41 61.16 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 118.228 -0.892 . . . . 0.0 112.793 -175.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -85.72 -26.23 26.0 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 117.034 -1.866 . . . . 0.0 109.0 -176.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 47.0 mt -58.64 -48.11 86.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -54.71 -54.54 40.47 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.513 -0.756 . . . . 0.0 110.467 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 29.8 t -60.67 -39.3 87.89 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.124 0.874 . . . . 0.0 110.299 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -68.96 -45.04 71.7 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.703 -0.623 . . . . 0.0 110.752 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.4 -33.56 76.16 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.319 1.048 . . . . 0.0 111.18 176.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -66.33 -51.51 56.54 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.444 1.498 . . . . 0.0 108.164 175.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -56.08 -45.07 79.48 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.237 0.926 . . . . 0.0 109.05 175.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.375 0 C-N-CA 124.876 1.27 . . . . 0.0 114.156 179.563 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.401 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m -68.04 162.66 24.07 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 175.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.453 ' CG ' ' H ' ' A' ' 8' ' ' ILE . 14.9 ttmt -132.33 -179.35 5.38 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 120.964 -1.085 . . . . 0.0 109.282 -177.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.453 ' H ' ' CG ' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -139.82 150.53 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 124.795 1.238 . . . . 0.0 109.063 178.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -96.74 79.92 3.01 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 102.012 -3.329 . . . . 0.0 102.012 174.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -65.95 -24.24 66.77 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 117.819 -1.086 . . . . 0.0 112.953 -175.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -66.41 -56.11 12.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 176.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.83 -45.15 87.37 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 122.065 -0.397 . . . . 0.0 111.303 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.6 m -60.6 -40.37 91.55 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 118.484 -0.77 . . . . 0.0 111.224 176.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -62.21 -32.87 73.58 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.586 178.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.33 9.07 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 120.242 1.383 . . . . 0.0 110.014 176.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.45 -48.36 71.81 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.823 -0.548 . . . . 0.0 111.828 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -52.86 -48.59 66.96 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 124.004 0.922 . . . . 0.0 110.436 175.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.69 -43.83 98.1 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 117.1 -1.429 . . . . 0.0 110.677 -178.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.6 mp -58.01 -60.53 3.58 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 119.483 1.038 . . . . 0.0 109.534 175.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 43.9 t -59.74 -31.64 47.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 121.846 -0.534 . . . . 0.0 111.407 -176.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -73.33 -26.7 61.15 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.437 -0.79 . . . . 0.0 111.296 176.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -80.15 123.73 28.16 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.22 0.918 . . . . 0.0 110.025 -176.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.406 ' CG ' HH12 ' A' ' 66' ' ' ARG . 1.5 m-20 -64.28 -23.0 67.15 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 123.66 0.784 . . . . 0.0 110.367 175.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.13 -3.87 88.67 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.075 1.798 . . . . 0.0 114.303 177.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.3 t -85.77 130.64 34.5 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.766 1.783 . . . . 0.0 109.608 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.6 -35.98 75.79 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 175.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 t -63.17 131.04 28.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -114.39 -23.6 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 126.034 1.733 . . . . 0.0 110.503 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 37.5 p-90 -131.09 141.77 50.2 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.296 1.039 . . . . 0.0 111.092 178.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.2 t -137.1 147.22 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 175.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.434 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 40.3 p -103.8 162.43 13.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.082 0.468 . . . . 0.0 109.83 178.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -134.32 141.82 47.05 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.768 1.627 . . . . 0.0 107.132 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -124.82 176.82 6.36 Favored 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 125.356 1.463 . . . . 0.0 107.569 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -113.9 145.05 42.04 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.456 0.646 . . . . 0.0 110.312 176.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -129.92 123.46 30.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 103.408 -2.812 . . . . 0.0 103.408 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 38.05 -94.28 0.01 OUTLIER Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.26 1.41 . . . . 0.0 113.883 -176.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.4 p -124.71 34.51 4.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.142 1.777 . . . . 0.0 112.994 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -144.71 172.86 12.41 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.321 1.048 . . . . 0.0 112.194 175.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.4 mm -98.4 132.35 43.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 C-N-CA 125.455 1.502 . . . . 0.0 107.028 176.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.5 m -120.65 160.52 43.94 Favored Pre-proline 0 C--O 1.235 0.327 0 C-N-CA 124.879 1.272 . . . . 0.0 110.251 175.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.02 160.88 44.85 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 120.971 1.114 . . . . 0.0 110.84 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -128.87 -173.11 13.33 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 106.837 -2.505 . . . . 0.0 106.837 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -69.8 171.59 8.98 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.822 -0.811 . . . . 0.0 111.212 177.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 -142.11 171.63 13.8 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.085 1.354 . . . . 0.0 111.749 -175.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.99 167.7 39.91 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-O 122.085 0.825 . . . . 0.0 112.695 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.93 -9.05 13.66 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 127.529 2.332 . . . . 0.0 112.474 -175.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.23 144.9 45.1 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 104.964 -2.235 . . . . 0.0 104.964 -177.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -84.06 -15.85 45.99 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -175.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -58.19 -37.22 74.35 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 120.916 1.689 . . . . 0.0 110.138 -178.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -73.38 -21.8 60.42 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.328 -0.857 . . . . 0.0 112.189 176.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -62.1 -46.47 88.91 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 120.423 1.465 . . . . 0.0 109.535 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.4 mp -61.39 -37.69 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -65.59 -39.04 91.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 122.668 0.387 . . . . 0.0 111.368 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -73.13 -24.02 60.55 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 126.543 1.937 . . . . 0.0 114.729 -175.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 85.1 m -63.67 118.12 7.8 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.836 ' HG1' ' CG2' ' A' ' 59' ' ' VAL 0.289 2.3 p -82.72 163.2 21.47 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 122.662 1.22 . . . . 0.0 111.458 -175.712 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -46.6 -75.48 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 130.655 3.582 . . . . 0.0 115.949 -175.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -102.04 -36.63 8.51 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -175.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.836 ' CG2' ' HG1' ' A' ' 56' ' ' THR . 18.5 m -62.12 166.98 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 -175.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -107.42 135.17 49.35 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 175.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.4 tp -132.29 170.82 14.51 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.179 1.792 . . . . 0.0 108.585 -175.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -136.33 157.03 47.77 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 124.537 1.135 . . . . 0.0 108.354 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.434 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -152.67 129.71 11.09 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 119.17 0.895 . . . . 0.0 112.875 175.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -89.78 123.52 33.84 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 105.154 -2.165 . . . . 0.0 105.154 175.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.5 t -138.93 149.93 23.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 122.865 0.466 . . . . 0.0 110.61 -175.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.406 HH12 ' CG ' ' A' ' 23' ' ' ASP . 11.0 ttp180 -103.28 145.5 29.86 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.108 0.963 . . . . 0.0 110.325 175.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -136.5 149.9 48.4 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.131 1.373 . . . . 0.0 110.728 -176.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 CA--C 1.532 0.267 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 175.768 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.9 m . . . . . 0 N--CA 1.445 -0.696 0 N-CA-C 103.06 -2.941 . . . . 0.0 103.06 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -64.4 162.76 14.45 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -175.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 67.3 mtt180 -136.16 154.2 51.04 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 122.773 1.273 . . . . 0.0 110.732 -176.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 47.8 t -145.75 160.0 42.37 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 177.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -144.27 168.11 20.85 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 104.824 -2.287 . . . . 0.0 104.824 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -121.55 139.77 53.08 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 105.744 -1.947 . . . . 0.0 105.744 176.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -123.94 114.03 19.26 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 104.817 -2.29 . . . . 0.0 104.817 -176.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -89.09 113.29 24.42 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 102.892 -3.003 . . . . 0.0 102.892 175.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -88.59 140.35 15.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -125.96 123.18 37.95 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 102.232 -3.247 . . . . 0.0 102.232 175.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 48.2 t-105 -101.6 123.85 46.28 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 25.4 mt -142.2 78.39 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.09 149.96 11.0 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 108.792 -1.723 . . . . 0.0 108.792 175.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -68.19 -10.72 56.46 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.43 2.115 . . . . 0.0 113.001 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -83.6 -36.32 24.01 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 117.256 -1.354 . . . . 0.0 113.191 -175.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -53.21 133.92 15.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 CA-C-N 120.354 1.434 . . . . 0.0 110.049 175.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 31.4 t -58.72 156.48 10.96 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 123.209 1.481 . . . . 0.0 113.032 -175.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.64 -13.8 13.07 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 113.175 -1.83 . . . . 0.0 111.617 175.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.7 tp -72.01 -61.28 1.85 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 126.098 1.759 . . . . 0.0 110.621 175.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -68.55 -34.25 75.52 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.8 ttm180 -60.37 -42.66 96.27 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 175.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.27 -36.34 83.8 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-O 118.107 -0.949 . . . . 0.0 111.617 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -55.84 -38.38 69.99 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.945 1.248 . . . . 0.0 110.602 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 74.2 m -54.31 -34.52 61.16 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 119.739 1.154 . . . . 0.0 110.467 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.75 -25.73 70.65 Favored Glycine 0 CA--C 1.527 0.806 0 O-C-N 121.009 -1.057 . . . . 0.0 113.761 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.7 m -99.12 -13.41 19.81 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.589 1.956 . . . . 0.0 110.88 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -103.41 -24.11 13.5 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -174.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -59.73 -39.96 86.44 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 120.986 1.721 . . . . 0.0 111.149 -178.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.9 t -62.56 -31.22 71.98 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 118.611 -0.709 . . . . 0.0 110.732 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 15.4 mt -62.81 -63.2 1.28 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 119.416 1.007 . . . . 0.0 109.573 -176.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.07 -30.36 47.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 117.188 -1.387 . . . . 0.0 109.455 175.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -61.91 -37.27 84.0 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 121.288 1.858 . . . . 0.0 110.288 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -60.79 -24.64 65.96 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 120.201 1.364 . . . . 0.0 111.117 179.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 43.7 t -86.82 -53.03 11.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 79.2 t -74.95 26.11 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 130.393 3.477 . . . . 0.0 111.427 -177.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -55.32 -26.13 38.74 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 119.618 -1.926 . . . . 0.0 112.492 -176.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -95.55 90.55 5.78 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 175.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -157.96 176.74 12.15 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.948 1.299 . . . . 0.0 108.041 179.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -106.31 -66.5 1.0 Allowed 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.829 -0.544 . . . . 0.0 112.013 177.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 14.0 mtpt -146.06 168.9 19.81 Favored 'General case' 0 CA--C 1.504 -0.826 0 C-N-CA 126.812 2.045 . . . . 0.0 110.017 176.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.33 179.72 4.19 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.82 -1.082 . . . . 0.0 109.553 175.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.25 140.63 23.25 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 104.256 -2.498 . . . . 0.0 104.256 -176.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.8 t -114.27 123.72 70.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -125.99 138.39 54.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 106.131 -1.803 . . . . 0.0 106.131 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.0 p -131.51 1.79 4.11 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -175.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -137.12 134.2 36.14 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.816 0.734 . . . . 0.0 109.455 177.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 17.3 ttp-105 -69.15 -28.83 66.78 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 118.195 -0.907 . . . . 0.0 112.723 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -70.42 -45.38 66.01 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 120.853 1.661 . . . . 0.0 106.623 175.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -58.37 -43.84 88.59 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 117.907 -1.044 . . . . 0.0 109.351 -176.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -44.04 -23.74 0.11 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 129.568 3.147 . . . . 0.0 115.081 -177.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -50.44 154.91 1.16 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 122.502 1.144 . . . . 0.0 114.064 175.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -61.08 -15.66 35.17 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 115.119 -0.946 . . . . 0.0 113.18 175.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -51.43 -64.95 0.65 Allowed 'General case' 0 C--O 1.242 0.689 0 CA-C-N 119.11 0.868 . . . . 0.0 111.022 176.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.92 -26.59 54.26 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 114.984 -2.686 . . . . 0.0 109.389 -175.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.7 -41.23 91.9 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 C-N-CA 123.7 0.8 . . . . 0.0 108.885 -176.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -62.1 -53.0 61.64 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 120.028 1.285 . . . . 0.0 109.929 179.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 44.0 t -65.08 -34.67 78.96 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 119.222 -0.418 . . . . 0.0 110.538 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -72.56 -44.38 62.16 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 123.902 0.881 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 65.0 mt -61.79 -31.05 71.23 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 118.342 -0.837 . . . . 0.0 108.853 175.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -69.43 -52.76 23.76 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.368 1.067 . . . . 0.0 109.298 174.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -51.34 -56.85 10.88 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.328 1.051 . . . . 0.0 109.531 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.691 0 C-N-CA 126.528 1.931 . . . . 0.0 113.794 177.816 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.517 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.4 m -119.05 170.89 8.66 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.63 1.972 . . . . 0.0 105.754 -177.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.0 tttt -139.04 176.28 8.83 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.612 -1.305 . . . . 0.0 111.247 -176.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.82 152.21 24.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 124.115 0.966 . . . . 0.0 108.961 175.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -100.34 78.6 2.05 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 104.678 -2.341 . . . . 0.0 104.678 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -61.89 -27.78 69.04 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.098 -0.953 . . . . 0.0 112.506 -175.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.22 -48.36 70.85 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 119.822 1.192 . . . . 0.0 110.255 177.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.16 -52.87 20.12 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.729 0.412 . . . . 0.0 110.121 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.9 m -62.31 -30.56 71.24 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.102 -0.951 . . . . 0.0 111.379 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.2 ttt180 -62.18 -35.19 78.1 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 115.946 -1.978 . . . . 0.0 109.112 175.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.87 -59.78 4.19 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 121.033 1.742 . . . . 0.0 109.906 -177.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.32 95.35 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.968 -0.458 . . . . 0.0 111.919 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -54.76 -46.31 74.34 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 175.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -58.07 -47.75 82.23 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.213 1.405 . . . . 0.0 110.102 -175.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -57.19 -62.92 1.42 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.014 0.926 . . . . 0.0 109.855 175.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.1 t -60.2 -24.95 32.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 O-C-N 121.559 -0.713 . . . . 0.0 112.244 -176.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -75.73 -31.33 59.57 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.45 1.1 . . . . 0.0 111.725 175.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.24 125.29 33.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 127.687 2.395 . . . . 0.0 112.665 -175.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.66 -19.47 58.4 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.232 1.013 . . . . 0.0 112.843 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.99 -10.09 86.42 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.015 1.293 . . . . 0.0 113.464 176.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.6 t -79.61 127.52 32.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 119.326 1.563 . . . . 0.0 109.053 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.36 -35.73 73.73 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 175.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.6 t -64.38 133.2 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 127.633 2.373 . . . . 0.0 108.571 175.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 pp -115.94 -23.66 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 126.109 1.763 . . . . 0.0 111.46 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 51.0 p-90 -123.57 147.87 46.88 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.838 0.855 . . . . 0.0 109.74 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.9 t -137.07 162.92 33.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 129.513 3.125 . . . . 0.0 107.835 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.434 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 41.3 p -125.18 159.15 32.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.61 1.164 . . . . 0.0 109.075 175.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -132.44 123.8 27.36 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -102.86 176.23 5.22 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 175.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -128.53 129.41 45.98 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 -175.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -129.08 131.02 47.23 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.919 1.688 . . . . 0.0 106.487 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 45.53 -114.53 1.28 Allowed Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.114 -1.195 . . . . 0.0 110.114 -176.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 p -120.74 45.61 2.2 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.968 1.307 . . . . 0.0 111.208 176.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.5 t -142.93 169.42 17.6 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.7 mm -98.61 139.4 20.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 175.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.3 m -128.53 146.18 58.94 Favored Pre-proline 0 N--CA 1.469 0.491 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.289 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.14 150.22 59.44 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 121.988 1.792 . . . . 0.0 109.288 175.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -124.3 -157.57 9.8 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 125.784 1.659 . . . . 0.0 110.629 177.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -51.56 161.5 0.49 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 125.906 1.682 . . . . 0.0 112.277 176.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.4 164.95 33.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.57 1.148 . . . . 0.0 109.124 176.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.73 176.96 44.05 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 123.578 0.609 . . . . 0.0 111.751 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -107.79 -15.61 14.52 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.355 1.462 . . . . 0.0 113.533 -176.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -123.63 142.63 50.86 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 -176.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -83.36 -8.91 59.33 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.799 1.036 . . . . 0.0 113.799 -174.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -54.1 -36.85 63.64 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.846 1.203 . . . . 0.0 110.137 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -62.68 -28.81 70.19 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.044 1.337 . . . . 0.0 112.158 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -63.52 -52.45 61.16 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -178.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.52 -36.78 76.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -176.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -60.83 -31.88 71.29 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.67 0.788 . . . . 0.0 112.102 175.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -85.67 -24.04 27.19 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.008 0.923 . . . . 0.0 113.455 -175.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 96.6 m -59.85 120.75 10.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.602 1.092 . . . . 0.0 112.539 -175.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 2.4 p -104.92 -173.53 2.32 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 127.181 2.192 . . . . 0.0 113.898 -178.219 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -73.67 -75.93 0.14 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 129.619 3.168 . . . . 0.0 117.964 -175.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -102.35 -24.76 13.83 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.051 1.74 . . . . 0.0 115.353 -174.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.7 m -63.94 158.78 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 CA-C-O 122.816 1.293 . . . . 0.0 112.37 -175.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.3 ptt-85 -108.41 130.65 55.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 102.894 -3.002 . . . . 0.0 102.894 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 31.8 tp -140.7 156.09 46.3 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -175.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -131.38 148.72 52.69 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.434 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.94 129.16 16.69 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.344 0.658 . . . . 0.0 111.629 -179.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -96.44 123.64 40.16 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 175.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.3 t -134.39 141.4 43.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 123.426 0.69 . . . . 0.0 109.304 -175.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -85.06 137.84 32.8 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 175.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -131.49 168.22 18.01 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 127.648 2.379 . . . . 0.0 106.622 -176.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.3 m . . . . . 0 C--N 1.325 -0.496 0 O-C-N 121.069 -1.02 . . . . 0.0 108.739 -177.295 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.4 m . . . . . 0 N--CA 1.45 -0.441 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -46.16 152.84 0.37 Allowed 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.35 1.86 . . . . 0.0 113.254 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 -121.21 148.32 44.42 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 123.638 0.775 . . . . 0.0 109.881 -176.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.6 t -146.89 137.82 23.92 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.658 1.583 . . . . 0.0 109.168 175.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.4 mmpt? -145.99 176.04 10.0 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 127.998 2.519 . . . . 0.0 108.115 175.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -141.56 146.36 36.23 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 176.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -125.47 122.44 36.65 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 176.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -97.65 113.33 25.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 100.421 -3.918 . . . . 0.0 100.421 174.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.9 mp -97.36 144.71 10.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -123.62 123.36 40.4 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 103.258 -2.867 . . . . 0.0 103.258 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -96.04 123.48 39.66 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 103.716 -2.698 . . . . 0.0 103.716 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.3 mt -144.91 97.77 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 104.134 -2.543 . . . . 0.0 104.134 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.62 166.02 4.75 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-O 121.717 0.621 . . . . 0.0 113.07 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -75.78 -19.23 59.15 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.213 -1.757 . . . . 0.0 110.009 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -82.72 -20.71 35.49 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 120.812 -1.18 . . . . 0.0 113.486 -175.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . 0.257 0.8 OUTLIER -66.33 140.16 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 119.852 1.205 . . . . 0.0 113.373 -177.777 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 47.7 t -70.88 144.59 50.62 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 126.136 1.774 . . . . 0.0 109.89 179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -60.51 -21.16 57.11 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-O 119.179 -0.79 . . . . 0.0 113.205 179.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 tt -65.06 -32.58 74.36 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.872 1.336 . . . . 0.0 110.062 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -80.09 -44.07 20.66 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 175.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.8 ttp85 -58.62 -25.03 62.24 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.514 1.052 . . . . 0.0 111.298 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.34 70.57 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 120.849 -1.157 . . . . 0.0 111.861 175.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -64.99 -39.12 92.99 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-O 118.032 -0.985 . . . . 0.0 108.764 175.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.5 m -54.26 -34.81 61.64 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.383 0.673 . . . . 0.0 110.137 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.67 -12.37 56.37 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 125.135 1.35 . . . . 0.0 114.805 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.6 m -125.45 2.7 7.68 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.784 2.034 . . . . 0.0 110.603 175.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -103.62 -42.93 5.51 Favored 'General case' 0 C--O 1.226 -0.157 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -177.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.46 ' HE2' ' HG3' ' A' ' 114' ' ' GLU . 9.3 mtpm? -59.59 -28.81 67.49 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.52 -1.363 . . . . 0.0 112.44 -176.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.5 t -68.14 -47.01 69.23 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.458 1.503 . . . . 0.0 108.855 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 14.5 mt -59.44 -58.04 10.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.855 1.662 . . . . 0.0 109.987 -176.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.4 p -62.21 -30.93 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-O 117.27 -1.347 . . . . 0.0 109.667 176.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.82 -31.16 72.24 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 121.178 1.808 . . . . 0.0 110.893 176.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -63.57 -25.73 68.37 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 120.154 1.343 . . . . 0.0 111.099 176.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 57.5 t -86.19 -56.97 4.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 175.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 86.3 t -73.01 26.65 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 131.106 3.762 . . . . 0.0 112.127 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -52.76 -21.63 4.34 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 119.679 -1.888 . . . . 0.0 113.717 -176.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -99.02 84.39 3.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 174.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -147.42 170.11 18.07 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 175.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 -66.32 0.91 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -176.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -152.85 169.26 23.25 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 127.12 2.168 . . . . 0.0 108.159 175.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.46 ' HG3' ' HE2' ' A' ' 101' ' ' LYS . 0.7 OUTLIER -107.19 167.77 9.68 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 175.193 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -137.6 152.17 49.11 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 -175.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.8 t -121.24 124.87 72.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 175.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mp -124.94 141.47 44.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 176.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.2 p -130.89 6.46 4.65 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.304 1.442 . . . . 0.0 112.827 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -139.81 128.87 23.65 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.573 0.624 . . . . 0.0 111.305 175.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 -64.99 -32.87 74.8 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 124.778 1.231 . . . . 0.0 113.966 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.479 ' H ' ' HE3' ' A' ' 121' ' ' LYS . 0.3 OUTLIER -76.21 -41.04 50.69 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 120.98 1.718 . . . . 0.0 109.667 176.622 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.9 -37.42 86.88 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.022 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -45.0 -23.65 0.16 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 129.382 3.073 . . . . 0.0 115.076 -176.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -44.41 140.19 2.4 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.74 1.216 . . . . 0.0 110.856 175.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.29 -14.56 2.94 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -54.01 -55.6 25.78 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 124.345 1.058 . . . . 0.0 111.97 177.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.42 -25.7 35.96 Favored 'General case' 0 C--N 1.352 0.682 0 C-N-CA 116.614 -2.035 . . . . 0.0 108.713 -177.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 64.8 mt -60.74 -49.04 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -55.61 -51.33 67.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.266 0.626 . . . . 0.0 109.878 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.0 t -63.88 -38.55 91.5 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.454 0.702 . . . . 0.0 111.007 -176.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -67.91 -40.29 83.46 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.838 1.255 . . . . 0.0 109.688 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 96.7 mt -72.82 -24.69 60.94 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.07 -1.018 . . . . 0.0 110.339 175.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.6 mtpt -73.78 -47.29 39.97 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 125.185 1.394 . . . . 0.0 108.403 175.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -54.01 -65.41 0.57 Allowed 'General case' 0 C--O 1.234 0.251 0 C-N-CA 126.247 1.819 . . . . 0.0 108.508 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 176.299 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.326 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 m -71.01 149.29 46.77 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.163 2.185 . . . . 0.0 106.283 175.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.6 mtmt -132.02 179.97 5.77 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.091 0.956 . . . . 0.0 109.413 -176.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.25 153.67 24.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 C-N-CA 124.129 0.971 . . . . 0.0 110.189 176.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -91.57 80.57 5.39 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 103.682 -2.71 . . . . 0.0 103.682 175.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -62.88 -27.4 69.33 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 117.383 -1.294 . . . . 0.0 111.94 -175.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -72.33 -53.9 11.05 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 119.64 1.109 . . . . 0.0 109.236 178.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.39 -43.82 96.47 Favored 'General case' 0 CA--C 1.527 0.069 0 CA-C-N 118.342 0.519 . . . . 0.0 111.064 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 81.2 m -70.27 -30.6 67.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.373 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -61.15 -34.54 75.18 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-O 116.834 -1.555 . . . . 0.0 109.853 176.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.28 -57.73 10.08 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 119.753 1.161 . . . . 0.0 110.157 -177.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.86 -41.94 86.5 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -52.7 -40.13 62.67 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 123.312 0.645 . . . . 0.0 111.104 175.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -63.21 -45.06 93.46 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.81 0.844 . . . . 0.0 110.574 -176.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.53 -50.68 72.57 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 123.853 0.861 . . . . 0.0 110.605 175.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.6 t -65.99 -30.52 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-O 119.49 -0.29 . . . . 0.0 111.218 -178.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -66.5 -48.84 68.54 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 118.077 -0.964 . . . . 0.0 108.725 175.764 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 21' ' ' ARG . 7.5 t70 -62.16 140.53 58.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 123.981 0.801 . . . . 0.0 112.289 -175.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -78.75 -19.51 52.13 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 117.566 -1.207 . . . . 0.0 113.691 -175.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -105.99 -1.66 39.14 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 118.846 -0.975 . . . . 0.0 114.096 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 t -71.74 147.95 46.85 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.365 1.582 . . . . 0.0 109.133 176.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.88 -33.11 59.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.328 176.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.7 t -74.79 123.48 30.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 175.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.2 pp -114.64 -23.89 4.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 C-N-CA 124.289 1.035 . . . . 0.0 110.874 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.402 ' CZ2' ' HA3' ' A' ' 45' ' ' GLY . 34.3 p-90 -124.64 144.98 49.89 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.632 0.773 . . . . 0.0 109.194 178.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.8 t -135.68 161.93 37.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 127.113 2.165 . . . . 0.0 107.594 176.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.474 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 72.3 p -125.55 157.83 36.1 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 175.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -127.5 123.71 36.57 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 176.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -94.46 176.01 6.46 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -119.65 137.5 53.84 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -137.47 123.97 20.86 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 50.67 -110.88 1.03 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.5 p -110.71 27.39 9.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.648 1.579 . . . . 0.0 112.56 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -148.07 172.6 14.01 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 119.25 0.932 . . . . 0.0 113.143 176.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.8 mm -99.0 134.19 38.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 105.063 -2.199 . . . . 0.0 105.063 175.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.1 m -127.66 159.62 65.08 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 123.186 0.594 . . . . 0.0 111.262 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.99 144.19 57.27 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 121.809 1.673 . . . . 0.0 110.428 175.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -113.83 -155.05 11.4 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 125.827 1.679 . . . . 0.0 110.078 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -63.56 159.61 18.38 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.688 1.195 . . . . 0.0 110.808 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -143.96 165.97 26.27 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 125.523 1.529 . . . . 0.0 109.043 176.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.402 ' HA3' ' CZ2' ' A' ' 29' ' ' TRP . . . -178.51 -175.65 45.78 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 124.016 0.817 . . . . 0.0 111.818 -176.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -118.39 -22.7 7.51 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.215 1.406 . . . . 0.0 112.465 -176.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -115.07 130.5 56.95 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 -176.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -83.04 -7.57 59.64 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.042 0.837 . . . . 0.0 111.456 -175.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -54.23 -37.16 64.3 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.283 -1.511 . . . . 0.0 111.69 175.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -70.11 -26.86 64.16 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.829 1.252 . . . . 0.0 112.444 177.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -62.49 -46.61 87.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.472 1.509 . . . . 0.0 109.477 -177.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 mp -61.12 -42.07 91.8 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -177.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -65.57 -24.01 66.98 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.369 0.531 . . . . 0.0 112.425 176.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -80.93 -23.9 38.56 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.842 1.201 . . . . 0.0 112.251 176.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 99.1 m -60.16 123.56 17.54 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 104.284 -2.488 . . . . 0.0 104.284 175.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 72.7 p -82.84 174.04 11.3 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -174.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.437 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 7.3 p-10 -60.76 -76.55 0.05 OUTLIER 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.433 2.293 . . . . 0.0 109.424 176.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.437 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 14.6 t70 -106.4 -36.53 6.79 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -175.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.5 m -60.62 165.7 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.293 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -174.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 28.1 ptt-85 -103.77 151.62 22.83 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 175.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.8 tp -148.65 161.53 41.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -127.16 151.07 49.16 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.58 157.87 43.92 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.088 0.555 . . . . 0.0 111.842 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -131.37 123.78 28.95 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 -178.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 39.6 t -137.67 141.63 38.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -175.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.2 ttp-105 -83.99 138.31 33.18 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 175.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -136.13 153.58 51.25 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 125.474 1.509 . . . . 0.0 107.837 -177.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 92.3 m . . . . . 0 N--CA 1.446 -0.631 0 O-C-N 121.124 -0.985 . . . . 0.0 109.122 -179.152 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 66.5 m . . . . . 0 N--CA 1.445 -0.691 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -61.32 155.4 21.36 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.583 0.706 . . . . 0.0 109.847 -177.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 46.6 mtp180 -133.55 176.32 8.65 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 126.044 1.738 . . . . 0.0 109.351 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 8.5 t -142.35 160.17 40.79 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 124.473 1.109 . . . . 0.0 110.109 -176.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -145.06 171.57 14.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 130.852 3.661 . . . . 0.0 106.608 176.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -143.18 143.44 31.78 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 175.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.57 118.3 31.77 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 178.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -87.88 113.7 23.79 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 101.988 -3.338 . . . . 0.0 101.988 175.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.6 mp -101.31 143.14 14.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 -176.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -125.69 123.58 39.23 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 175.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -93.37 123.72 36.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 104.868 -2.271 . . . . 0.0 104.868 175.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.8 mt -143.12 92.29 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -58.93 156.11 24.84 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 108.308 -1.917 . . . . 0.0 108.308 175.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -74.33 -4.43 36.25 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 119.997 -1.884 . . . . 0.0 111.084 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -83.83 -36.4 23.52 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 121.254 -0.904 . . . . 0.0 110.771 -175.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.5 p -64.45 128.99 27.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 175.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.4 t -60.5 154.33 21.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.527 1.156 . . . . 0.0 111.745 -175.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -53.67 -30.84 44.19 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 125.59 1.567 . . . . 0.0 113.179 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.6 tt -62.97 -41.44 99.55 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.489 1.116 . . . . 0.0 111.12 178.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -76.92 -41.24 44.29 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.45 -35.0 62.53 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.64 1.109 . . . . 0.0 109.806 175.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.37 -30.25 64.72 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 119.877 1.217 . . . . 0.0 113.412 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 23.7 mmtp -57.88 -31.91 67.17 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 119.384 0.993 . . . . 0.0 110.833 175.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.5 m -56.65 -33.98 66.87 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.493 1.042 . . . . 0.0 109.933 -178.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.23 -14.97 67.14 Favored Glycine 0 CA--C 1.535 1.324 0 CA-C-O 119.143 -0.81 . . . . 0.0 113.834 177.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.8 m -112.32 -4.62 14.27 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.684 2.394 . . . . 0.0 110.245 176.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -104.48 -35.36 7.92 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 124.257 1.023 . . . . 0.0 111.532 -175.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -59.6 -34.71 73.09 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.108 -0.995 . . . . 0.0 111.058 -177.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 7.0 t -66.98 -33.87 76.52 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.804 1.241 . . . . 0.0 110.369 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 13.2 mt -70.91 -63.29 1.13 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.687 1.195 . . . . 0.0 108.88 -176.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.267 0.9 OUTLIER -59.46 -25.2 30.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-O 117.909 -1.043 . . . . 0.0 109.537 175.562 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -61.8 -41.97 98.42 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 120.909 1.686 . . . . 0.0 108.818 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -51.03 -31.03 17.08 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 120.704 1.593 . . . . 0.0 111.75 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 96.4 t -85.32 -63.57 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 124.685 1.194 . . . . 0.0 108.096 175.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 45.0 t -71.14 26.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 C-N-CA 130.566 3.546 . . . . 0.0 112.824 -175.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -57.63 -26.96 62.35 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.776 -1.828 . . . . 0.0 113.525 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -91.56 79.87 5.45 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 175.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -144.0 165.05 28.84 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 123.225 0.61 . . . . 0.0 109.569 177.725 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.63 -66.63 0.89 Allowed 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.36 175.72 12.8 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 126.451 1.901 . . . . 0.0 109.176 -175.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -115.41 164.51 14.17 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 123.429 0.456 . . . . 0.0 110.67 175.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -139.95 142.22 36.39 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 102.659 -3.089 . . . . 0.0 102.659 -175.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.34 128.5 73.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 176.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -128.25 145.14 35.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 125.985 1.714 . . . . 0.0 106.796 -176.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 42.0 p -131.31 -7.07 3.79 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.558 1.143 . . . . 0.0 113.464 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -116.73 130.08 56.51 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 15.2 ttp-105 -72.88 -28.54 62.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 118.61 -0.71 . . . . 0.0 111.964 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -69.89 -45.79 66.88 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 119.503 1.047 . . . . 0.0 109.017 175.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -53.55 -47.36 70.09 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 124.434 1.094 . . . . 0.0 110.16 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -43.91 -24.11 0.12 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 128.483 2.713 . . . . 0.0 116.793 -175.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -44.6 143.38 1.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 124.097 0.959 . . . . 0.0 110.636 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -60.33 -21.19 61.75 Favored 'General case' 0 C--N 1.341 0.213 0 O-C-N 121.587 -0.695 . . . . 0.0 111.024 -178.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -46.1 -59.17 3.03 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 125.34 1.456 . . . . 0.0 112.308 -175.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -81.15 -26.33 36.17 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 115.933 -2.307 . . . . 0.0 109.274 -176.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 36.2 mt -57.83 -44.07 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -60.34 -50.22 74.49 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 123.54 0.736 . . . . 0.0 111.64 -175.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -75.7 -30.68 59.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.554 0.616 . . . . 0.0 111.368 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.09 -46.46 81.02 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.044 -1.035 . . . . 0.0 108.922 176.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.64 -26.16 67.69 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.084 0.954 . . . . 0.0 111.648 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -63.59 -60.54 3.2 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 175.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? -53.82 -57.36 11.19 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 123.652 0.595 . . . . 0.0 110.474 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.369 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -176.281 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.379 0 N-CA-C 110.361 -1.095 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.0 pt -131.19 98.02 3.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 125.669 1.588 . . . . 0.0 107.009 178.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 69.6 mtp85 -103.57 148.67 25.71 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.5 tpt -71.33 82.11 0.76 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 175.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -144.19 44.52 1.44 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 127.243 2.217 . . . . 0.0 108.105 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.6 m -83.72 172.64 12.05 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.417 2.287 . . . . 0.0 107.538 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.513 ' HG3' ' H ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -150.14 -177.12 5.74 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 119.908 -1.745 . . . . 0.0 111.298 -175.407 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.513 ' H ' ' HG3' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -142.8 146.75 21.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 C-N-CA 127.312 2.245 . . . . 0.0 105.384 175.073 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -92.07 83.42 5.13 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 102.167 -3.271 . . . . 0.0 102.167 174.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.9 pttt -58.22 -33.48 69.37 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-O 117.167 -1.397 . . . . 0.0 113.064 -175.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -78.03 -44.26 27.0 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 120.354 1.434 . . . . 0.0 110.353 -176.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.8 -40.06 94.61 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 119.249 0.932 . . . . 0.0 110.537 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 62.0 m -72.45 -34.8 68.01 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.45 -0.781 . . . . 0.0 110.625 178.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.98 -35.97 74.1 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.904 175.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.14 -54.15 49.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 119.071 0.851 . . . . 0.0 109.997 -176.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.46 -40.96 85.35 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.665 0.666 . . . . 0.0 111.297 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -50.62 -47.89 58.18 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.264 0.626 . . . . 0.0 110.781 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -54.66 -41.04 69.67 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.899 1.28 . . . . 0.0 111.636 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 mp -68.81 -61.52 1.77 Allowed 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 124.183 0.993 . . . . 0.0 110.697 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.3 t -55.83 -31.55 30.19 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.783 -175.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -29.98 67.83 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.617 1.099 . . . . 0.0 111.916 175.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -85.6 125.84 33.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.665 1.121 . . . . 0.0 112.546 -175.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -61.79 -15.8 44.5 Favored 'General case' 0 C--N 1.344 0.346 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 175.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.91 -9.37 57.35 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 125.286 1.422 . . . . 0.0 112.61 176.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.0 t -66.8 127.08 31.11 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 120.338 2.069 . . . . 0.0 108.162 175.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.8 -32.73 73.97 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.7 t -72.57 123.69 27.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 104.424 -2.436 . . . . 0.0 104.424 175.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -113.29 -25.27 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 C-N-CA 123.33 0.652 . . . . 0.0 109.974 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 24.7 p-90 -126.03 145.87 50.13 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 121.838 0.828 . . . . 0.0 109.418 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.0 t -138.33 159.97 31.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 127.664 2.386 . . . . 0.0 106.024 175.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 35.4 p -120.2 153.54 36.12 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 175.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -122.3 123.7 42.03 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 104.805 -2.295 . . . . 0.0 104.805 175.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 41.6 mmtt -102.37 176.46 5.17 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.538 1.935 . . . . 0.0 105.999 -177.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -126.44 152.32 46.56 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 175.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -146.63 163.92 34.3 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 125.888 1.675 . . . . 0.0 107.564 175.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 24.36 -88.18 0.01 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 128.51 2.957 . . . . 0.0 115.311 178.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 27.0 p -136.12 26.74 3.23 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.726 1.211 . . . . 0.0 110.154 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -142.53 157.24 44.94 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -175.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 1.8 mp -84.99 142.95 12.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 N-CA-C 103.935 -2.617 . . . . 0.0 103.935 175.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.46 161.72 57.34 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 125.398 1.479 . . . . 0.0 110.206 -177.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -71.41 152.89 61.02 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 121.572 1.515 . . . . 0.0 110.169 175.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -120.86 -152.37 8.82 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 126.103 1.811 . . . . 0.0 109.767 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.19 163.11 10.74 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.243 1.417 . . . . 0.0 110.458 175.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -141.77 161.19 38.56 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 126.455 1.902 . . . . 0.0 109.429 177.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -176.09 -179.66 46.68 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-O 121.981 0.767 . . . . 0.0 112.623 177.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.6 -13.93 9.13 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.433 1.493 . . . . 0.0 112.534 -176.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -120.73 130.98 54.28 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.524 1.13 . . . . 0.0 107.958 -175.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -83.48 -13.08 55.45 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -175.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -57.81 -43.48 85.75 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 119.776 -1.827 . . . . 0.0 109.635 175.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -68.85 -21.93 64.25 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 119.048 -0.501 . . . . 0.0 111.585 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -61.45 -43.86 98.12 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 120.373 1.442 . . . . 0.0 107.9 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.3 mm -56.71 -47.27 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 123.475 0.71 . . . . 0.0 109.268 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -61.2 -40.25 93.27 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.527 0.731 . . . . 0.0 111.315 -177.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -69.87 -23.33 63.24 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 125.528 1.531 . . . . 0.0 113.894 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.5 m -65.23 113.55 4.08 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 176.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.301 2.1 p -91.07 -174.43 3.98 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.039 2.135 . . . . 0.0 111.746 -176.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -81.26 -75.95 0.26 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -175.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -95.19 -25.41 16.4 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 -175.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 8.4 m -63.72 149.2 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 O-C-N 120.706 -1.246 . . . . 0.0 108.569 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -103.28 129.44 50.28 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 103.174 -2.899 . . . . 0.0 103.174 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.3 tp -130.0 160.59 33.19 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -130.82 153.34 49.19 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 175.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -138.8 158.73 43.68 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.466 0.65 . . . . 0.0 110.338 175.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -129.64 123.48 31.33 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 103.88 -2.637 . . . . 0.0 103.88 177.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.3 t -134.53 135.34 53.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -175.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 59.5 ttp85 -80.64 123.63 28.31 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 104.883 -2.266 . . . . 0.0 104.883 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -135.26 123.83 23.57 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.278 1.037 . . . . 0.0 110.248 -175.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 26.8 m -86.41 114.09 22.9 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 124.364 1.066 . . . . 0.0 111.589 -175.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.3 m -156.49 166.63 32.86 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 175.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 101.91 113.79 3.75 Favored Glycine 0 CA--C 1.501 -0.797 0 N-CA-C 103.765 -3.734 . . . . 0.0 103.765 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -99.45 113.63 26.1 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 111.935 -2.133 . . . . 0.0 108.374 -174.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.96 178.28 8.65 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 125.41 1.484 . . . . 0.0 108.008 175.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.6 mmt -71.63 9.0 0.94 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.789 0.836 . . . . 0.0 110.621 175.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.5 m -146.34 151.51 37.61 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 118.928 -2.358 . . . . 0.0 107.387 175.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -63.21 157.81 21.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.327 0.585 . . . . 0.0 110.706 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.1 mtt-85 -141.86 155.54 45.54 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 105.05 -2.204 . . . . 0.0 105.05 175.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 t -144.25 160.85 40.29 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.4 mtpt -145.81 176.47 9.64 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 126.395 1.878 . . . . 0.0 108.795 -175.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -135.68 140.4 44.44 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -121.19 117.82 28.09 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.965 1.706 . . . . 0.0 107.222 -176.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -87.97 113.58 23.76 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 105.091 -2.188 . . . . 0.0 105.091 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.7 mt -104.4 143.2 16.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 -176.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -123.94 123.71 41.01 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 175.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -96.49 123.75 40.26 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 125.766 1.626 . . . . 0.0 106.731 175.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.4 mt -143.4 97.38 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 176.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -60.64 169.73 8.26 Favored Glycine 0 CA--C 1.537 1.431 0 CA-C-N 119.816 1.189 . . . . 0.0 112.101 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -76.96 -12.39 59.94 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 119.991 -1.888 . . . . 0.0 109.978 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -83.15 -29.69 28.45 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 120.207 -1.558 . . . . 0.0 112.511 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.7 125.35 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 CA-C-O 121.586 0.708 . . . . 0.0 111.831 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 18.9 t -64.85 150.27 47.97 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 124.529 1.131 . . . . 0.0 110.681 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.45 -28.01 58.94 Favored Glycine 0 CA--C 1.521 0.448 0 C-N-CA 125.339 1.447 . . . . 0.0 113.913 -178.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.6 tt -59.2 -37.35 77.24 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.116 1.458 . . . . 0.0 110.241 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -73.76 -43.82 57.91 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 121.266 -0.896 . . . . 0.0 109.073 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -57.27 -28.93 63.42 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.847 -0.597 . . . . 0.0 110.359 177.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.74 -44.38 97.01 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 119.599 1.091 . . . . 0.0 109.703 176.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.07 -54.98 40.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 118.014 -0.994 . . . . 0.0 108.331 175.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 59.7 m -50.58 -39.63 50.18 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.925 0.89 . . . . 0.0 110.112 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.04 -26.4 74.03 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 118.562 -1.132 . . . . 0.0 113.745 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.1 m -105.07 -0.41 26.72 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.627 1.571 . . . . 0.0 110.981 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -103.96 -24.16 13.27 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 124.809 1.244 . . . . 0.0 110.084 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.416 ' HZ2' ' CG2' ' A' ' 116' ' ' VAL . 37.0 mttt -52.57 -37.96 58.99 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 119.883 1.22 . . . . 0.0 111.5 175.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.1 t -56.82 -41.68 78.25 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.067 0.849 . . . . 0.0 110.393 175.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 28.4 mt -64.18 -64.74 0.8 Allowed 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 125.871 1.668 . . . . 0.0 109.685 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -57.51 -30.76 37.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 117.852 -1.071 . . . . 0.0 110.257 175.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -65.42 -31.35 72.41 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 120.739 1.609 . . . . 0.0 110.468 176.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -63.52 -23.8 67.55 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 121.112 1.778 . . . . 0.0 111.966 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 81.1 t -85.55 -53.82 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 175.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 53.7 t -78.28 25.9 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 128.012 2.525 . . . . 0.0 111.993 -175.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -58.07 -25.65 61.53 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 120.031 -1.668 . . . . 0.0 109.864 175.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.01 67.8 4.8 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.298 1.839 . . . . 0.0 106.688 175.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.12 174.53 11.23 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 121.157 -0.964 . . . . 0.0 111.778 179.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -110.27 -47.63 3.27 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.761 0.825 . . . . 0.0 110.868 -176.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.2 mptt -158.7 174.68 14.67 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 128.414 2.686 . . . . 0.0 107.486 175.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -120.19 163.19 18.11 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.081 1.752 . . . . 0.0 109.661 176.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -140.54 156.64 46.25 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 103.744 -2.688 . . . . 0.0 103.744 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.416 ' CG2' ' HZ2' ' A' ' 101' ' ' LYS . 90.8 t -132.58 127.97 57.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.5 mp -134.07 145.86 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 125.958 1.703 . . . . 0.0 109.21 -175.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 78.3 p -138.9 -5.9 1.48 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 126.664 1.985 . . . . 0.0 114.032 -175.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -141.54 153.94 45.17 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 119.227 0.921 . . . . 0.0 109.542 -176.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -37.94 89.22 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.954 -1.092 . . . . 0.0 111.523 -178.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 8.0 mttp -66.05 -31.14 71.85 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 124.745 1.218 . . . . 0.0 110.315 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -77.37 -23.39 50.81 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.448 1.899 . . . . 0.0 110.208 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -82.9 -23.13 33.69 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 127.025 2.13 . . . . 0.0 112.658 -178.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -57.9 123.47 15.92 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.183 0.901 . . . . 0.0 111.728 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.8 -23.98 55.09 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 115.639 1.718 . . . . 0.0 115.639 177.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -61.12 -55.61 30.49 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -174.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -74.58 -26.26 59.81 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 117.632 -1.627 . . . . 0.0 109.662 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 54.0 mt -56.86 -34.66 44.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 124.652 1.181 . . . . 0.0 109.144 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 38.9 mttt -55.79 -55.4 32.86 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 120.172 1.351 . . . . 0.0 110.063 175.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 5.2 t -67.98 -34.91 77.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.501 0.32 . . . . 0.0 110.507 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.482 ' CD ' ' HZ3' ' A' ' 134' ' ' LYS . 7.4 tp10 -63.63 -42.42 98.15 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.227 -0.921 . . . . 0.0 109.236 178.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 56.4 mt -69.95 -23.52 63.2 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.167 1.387 . . . . 0.0 111.45 175.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -74.89 -51.02 14.93 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 174.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.482 ' HZ3' ' CD ' ' A' ' 131' ' ' GLU . 40.7 mtpt -53.24 -56.73 14.16 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.025 1.33 . . . . 0.0 109.765 175.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.77 -14.27 62.41 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.892 0.877 . . . . 0.0 112.656 178.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -84.54 -67.79 1.42 Allowed Glycine 0 C--N 1.333 0.368 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 148.05 164.16 11.18 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 129.399 3.38 . . . . 0.0 107.747 -175.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -153.57 167.5 29.3 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.429 1.092 . . . . 0.0 109.121 176.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -154.25 153.54 31.9 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 128.845 2.858 . . . . 0.0 105.859 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -148.26 88.79 1.67 Allowed 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 105.239 -2.134 . . . . 0.0 105.239 175.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -154.04 143.95 21.87 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 127.324 2.25 . . . . 0.0 105.529 176.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.63 69.24 0.6 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.896 0.771 . . . . 0.0 112.322 -176.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -146.56 170.21 17.37 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.151 0.887 . . . . 0.0 109.344 175.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.5 m 86.24 23.66 0.07 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 129.826 3.25 . . . . 0.0 109.699 -175.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 C--O 1.247 0.963 0 C-N-CA 131.586 3.954 . . . . 0.0 102.726 175.474 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.649 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.1 tt -76.02 123.4 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -174.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 29.2 ttm105 -126.73 129.72 48.95 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 175.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 9.8 mtt -71.54 69.87 0.63 Allowed 'General case' 0 C--O 1.236 0.395 0 C-N-CA 126.038 1.735 . . . . 0.0 109.977 176.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.42 146.29 43.01 Favored 'General case' 0 C--O 1.238 0.48 0 O-C-N 121.684 -0.635 . . . . 0.0 109.626 177.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m -66.99 165.59 15.31 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -123.93 -176.13 3.4 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.526 -1.359 . . . . 0.0 111.327 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -143.64 156.62 16.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 124.002 0.921 . . . . 0.0 110.45 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -100.79 85.74 2.95 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 102.587 -3.116 . . . . 0.0 102.587 174.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -65.46 -32.26 73.78 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 117.927 -1.035 . . . . 0.0 111.962 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -67.76 -50.49 56.85 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.847 1.203 . . . . 0.0 109.815 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.03 -45.9 76.06 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -177.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.7 m -72.31 -30.86 65.18 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 118.754 -0.641 . . . . 0.0 111.297 -177.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 51.1 ttm-85 -67.34 -31.99 72.62 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 116.952 -1.499 . . . . 0.0 108.84 175.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.09 -60.0 3.99 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 120.494 1.497 . . . . 0.0 109.744 -178.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.98 -38.86 89.61 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.171 0.442 . . . . 0.0 111.529 -177.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -56.5 -41.69 77.11 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 122.736 0.414 . . . . 0.0 110.219 176.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -62.03 -45.93 91.4 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 124.61 1.164 . . . . 0.0 110.27 -177.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.84 -59.8 4.86 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 175.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.5 t -60.96 -26.1 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 CA-C-O 117.93 -1.033 . . . . 0.0 111.236 -176.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.7 ttt85 -66.79 -39.47 87.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 119.933 1.242 . . . . 0.0 110.097 175.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -64.92 123.9 20.63 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.0 -29.16 67.04 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.499 1.119 . . . . 0.0 111.111 176.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.17 -10.13 66.53 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 118.135 -1.369 . . . . 0.0 114.177 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.5 t -71.21 135.62 47.62 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 120.292 2.046 . . . . 0.0 108.05 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.01 -25.99 67.97 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.502 175.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.0 t -75.48 123.69 31.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 105.98 -1.859 . . . . 0.0 105.98 175.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.03 -25.12 3.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 C-N-CA 123.125 0.57 . . . . 0.0 110.333 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.1 p-90 -125.33 147.21 49.23 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 119.113 0.869 . . . . 0.0 109.25 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.5 t -139.83 162.96 25.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 128.032 2.533 . . . . 0.0 107.306 178.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.478 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 80.7 p -128.33 161.55 29.15 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 175.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -133.6 123.69 25.54 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.5 mmtt -94.37 176.41 6.31 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 176.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -118.93 142.9 47.36 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 175.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -137.1 152.48 50.05 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 175.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 32.86 -98.96 0.01 OUTLIER Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.629 2.061 . . . . 0.0 113.646 176.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.29 39.44 3.25 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.058 1.743 . . . . 0.0 110.467 176.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -142.08 175.69 9.54 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.508 1.123 . . . . 0.0 111.503 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 32.0 mm -107.31 135.52 45.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 104.729 -2.322 . . . . 0.0 104.729 175.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.4 m -129.47 158.05 74.48 Favored Pre-proline 0 N--CA 1.47 0.532 0 CA-C-O 118.741 -0.647 . . . . 0.0 110.472 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.71 165.4 32.84 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 121.962 1.775 . . . . 0.0 110.355 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -134.16 -157.86 8.35 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 125.485 1.517 . . . . 0.0 110.557 176.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.8 mp0 -59.03 158.44 8.57 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 125.212 1.405 . . . . 0.0 109.398 176.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -156.78 155.59 31.84 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.768 1.227 . . . . 0.0 108.107 -176.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.7 -179.15 40.73 Favored Glycine 0 CA--C 1.527 0.782 0 CA-C-O 121.589 0.549 . . . . 0.0 113.156 -175.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.85 -26.24 11.33 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.101 1.36 . . . . 0.0 112.186 177.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -111.77 128.94 56.25 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 -175.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -83.08 -10.61 58.61 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.611 1.964 . . . . 0.0 113.11 -175.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -53.96 -37.98 64.49 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 120.06 1.3 . . . . 0.0 110.572 175.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -69.01 -34.06 74.65 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.413 1.085 . . . . 0.0 111.602 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -58.48 -39.23 79.41 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.559 1.144 . . . . 0.0 109.51 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.9 mm -59.79 -32.55 49.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 123.874 0.87 . . . . 0.0 109.173 -176.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -79.31 -24.05 43.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.034 1.334 . . . . 0.0 112.441 -176.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -80.94 -23.55 38.77 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.634 1.174 . . . . 0.0 112.609 -175.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 79.6 m -79.39 114.47 18.35 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.777 1.231 . . . . 0.0 108.918 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.2 p -130.16 -173.6 3.09 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 122.475 1.131 . . . . 0.0 111.259 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.488 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 9.6 p-10 -40.77 -76.57 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.49 1 C-N-CA 134.673 5.189 . . . . 0.0 117.67 -175.862 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.488 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 17.2 t70 -106.21 -6.46 18.47 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 125.958 1.703 . . . . 0.0 114.077 -175.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.8 m -68.69 131.32 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 O-C-N 120.816 -1.177 . . . . 0.0 110.063 -176.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.6 ptt-85 -103.95 123.51 47.3 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 101.216 -3.624 . . . . 0.0 101.216 175.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.6 tp -141.76 163.21 33.53 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 123.619 0.767 . . . . 0.0 110.01 -175.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -131.48 152.12 50.98 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.478 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -142.32 163.75 32.02 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.315 0.579 . . . . 0.0 111.274 176.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -138.06 123.68 19.75 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 105.3 -2.111 . . . . 0.0 105.3 -176.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.0 t -133.72 138.46 50.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -175.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.1 ttp-105 -80.91 114.9 20.11 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 175.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -131.85 133.33 44.53 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.615 1.166 . . . . 0.0 108.986 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m -95.82 131.77 41.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 122.232 1.015 . . . . 0.0 111.034 -176.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 34.7 m -83.72 132.62 34.84 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 104.673 -2.343 . . . . 0.0 104.673 175.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -37.67 131.72 1.3 Allowed Glycine 0 C--N 1.339 0.7 0 C-N-CA 125.451 1.5 . . . . 0.0 110.798 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -50.43 166.1 0.08 Allowed 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 127.265 2.226 . . . . 0.0 116.898 -175.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.426 ' C ' ' H ' ' A' ' 74' ' ' SER . . . -146.17 -173.21 4.11 Favored 'General case' 0 N--CA 1.447 -0.592 1 C-N-CA 133.072 4.549 . . . . 0.0 103.184 175.357 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 92.8 mtp -60.59 2.9 0.09 Allowed 'General case' 0 CA--C 1.552 1.021 0 O-C-N 120.651 -1.28 . . . . 0.0 112.706 175.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.426 ' H ' ' C ' ' A' ' 72' ' ' ALA . 69.3 m -146.31 145.36 30.31 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 127.778 2.431 . . . . 0.0 106.788 175.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.3 mmtm -64.5 167.73 6.71 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.49 1.138 . . . . 0.0 112.82 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.48 148.12 42.25 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 175.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.6 t -146.51 123.92 11.67 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 104.513 -2.403 . . . . 0.0 104.513 175.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.6 mttt -135.93 176.37 8.75 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -175.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -132.31 127.17 35.03 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.037 -176.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.57 117.76 34.84 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.883 1.673 . . . . 0.0 106.82 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -87.11 113.31 22.75 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 104.3 -2.481 . . . . 0.0 104.3 175.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mt -98.23 146.55 7.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 -176.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.2 m -126.03 123.58 38.76 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 103.317 -2.846 . . . . 0.0 103.317 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 25.6 t-105 -103.28 123.46 46.82 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 175.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 13.3 mm -143.03 101.44 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 105.386 -2.079 . . . . 0.0 105.386 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -60.42 154.63 33.85 Favored Glycine 0 CA--C 1.535 1.303 0 N-CA-C 108.329 -1.909 . . . . 0.0 108.329 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -74.57 -3.35 30.51 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 120.342 -1.681 . . . . 0.0 111.177 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -82.95 -36.01 25.52 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 120.833 -1.167 . . . . 0.0 109.248 -175.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -70.91 123.82 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 104.921 -2.252 . . . . 0.0 104.921 175.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.9 t -78.52 171.74 14.68 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 122.759 1.266 . . . . 0.0 113.547 -174.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -46.84 -35.36 7.76 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 129.12 3.248 . . . . 0.0 113.661 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 tt -62.49 -57.38 11.41 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 119.937 1.869 . . . . 0.0 110.719 176.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -66.1 -37.77 86.59 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 121.774 -0.579 . . . . 0.0 109.885 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -61.41 -33.1 73.13 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.832 -0.542 . . . . 0.0 110.012 175.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.4 -28.63 69.92 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 117.952 -1.023 . . . . 0.0 111.156 176.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -63.06 -55.47 25.2 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 175.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.0 m -50.33 -47.28 55.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.769 0.827 . . . . 0.0 109.764 175.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -59.62 -25.73 61.42 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.026 0.822 . . . . 0.0 114.263 178.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 49.5 m -103.12 -9.41 19.71 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 127.82 2.448 . . . . 0.0 111.155 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -104.52 -23.56 13.12 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 127.118 2.167 . . . . 0.0 112.238 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -48.36 -36.67 14.97 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 119.896 1.226 . . . . 0.0 113.061 176.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.0 t -59.76 -34.2 72.68 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 15.4 mt -68.33 -61.66 1.74 Allowed 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 126.616 1.966 . . . . 0.0 109.963 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.2 p -61.84 -30.4 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 117.502 -1.237 . . . . 0.0 108.489 175.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -41.69 99.52 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 120.76 1.618 . . . . 0.0 109.23 175.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -58.91 -25.63 63.58 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.46 1.027 . . . . 0.0 112.806 177.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 29.9 t -86.04 -54.07 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 59.1 t -76.09 21.93 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 C-N-CA 128.753 2.821 . . . . 0.0 112.218 -175.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -48.83 -22.76 0.88 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.862 1.665 . . . . 0.0 115.309 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -107.29 85.21 2.09 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -147.51 175.26 10.98 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.351 1.86 . . . . 0.0 108.524 176.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.14 -60.37 1.62 Allowed 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -175.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.49 173.76 12.01 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.873 1.269 . . . . 0.0 110.325 -178.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -126.59 158.62 35.78 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.452 1.101 . . . . 0.0 111.034 175.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -138.53 155.42 48.41 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 104.949 -2.241 . . . . 0.0 104.949 -175.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 46.8 t -128.53 130.11 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 175.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.5 mp -132.65 153.15 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 126.468 1.907 . . . . 0.0 107.099 -176.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.6 p -149.26 -9.85 0.32 Allowed 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.451 1.901 . . . . 0.0 114.443 -175.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -129.9 154.92 46.83 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.211 1.005 . . . . 0.0 110.756 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.544 HH12 ' CD ' ' A' ' 124' ' ' GLU . 0.0 OUTLIER -69.49 -29.75 67.47 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.587 -176.586 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -76.48 -46.59 26.11 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 121.501 1.955 . . . . 0.0 107.096 174.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -55.34 -23.9 26.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.916 2.087 . . . . 0.0 112.258 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -79.66 -22.87 42.98 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.747 1.619 . . . . 0.0 113.709 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.544 ' CD ' HH12 ' A' ' 120' ' ' ARG . 18.8 mt-10 -69.74 129.04 38.5 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 116.031 1.863 . . . . 0.0 116.031 -175.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.423 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 14.2 mm-40 -53.09 -17.47 1.58 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 125.538 1.535 . . . . 0.0 114.849 175.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.408 ' HA ' ' NZ ' ' A' ' 129' ' ' LYS 0.36 15.3 t70 -65.11 -57.95 7.29 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 117.657 -1.617 . . . . 0.0 112.756 -175.605 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -77.69 -26.3 50.14 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 117.949 -1.5 . . . . 0.0 109.907 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.423 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 51.7 mt -56.53 -40.89 71.07 Favored 'Isoleucine or valine' 0 C--N 1.344 0.345 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.408 ' NZ ' ' HA ' ' A' ' 126' ' ' ASP . 28.1 mtmm -52.85 -52.35 57.58 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 119.905 1.229 . . . . 0.0 111.283 176.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.2 t -73.79 -24.19 59.8 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.622 -178.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -67.63 -49.75 61.42 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 175.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.01 -23.9 62.34 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.29 1.036 . . . . 0.0 111.092 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -67.5 -52.93 33.3 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 174.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -53.73 -48.82 69.27 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.588 1.085 . . . . 0.0 110.103 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.27 -7.96 11.15 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.415 1.086 . . . . 0.0 112.378 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -98.48 -62.88 0.86 Allowed Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 107.082 -2.407 . . . . 0.0 107.082 175.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -167.89 -168.93 30.73 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.617 1.103 . . . . 0.0 111.149 -179.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.7 172.23 5.49 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.275 0.63 . . . . 0.0 111.398 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -136.92 103.72 5.25 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 103.85 -2.648 . . . . 0.0 103.85 175.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -130.66 116.27 17.84 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 103.013 -2.958 . . . . 0.0 103.013 -176.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -111.93 158.56 19.33 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 128.278 2.631 . . . . 0.0 104.694 175.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -73.74 86.43 1.68 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.79 0.723 . . . . 0.0 110.224 -175.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -136.69 91.41 2.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.065 1.346 . . . . 0.0 109.277 -175.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 86.46 56.4 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 127.307 2.243 . . . . 0.0 110.448 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 . . . . . 0 C--O 1.249 1.067 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 175.464 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.649 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.5 mt -80.4 91.05 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 173.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.17 81.11 1.06 Allowed 'General case' 0 N--CA 1.466 0.332 0 O-C-N 120.999 -1.063 . . . . 0.0 109.778 176.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.18 176.02 9.63 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.641 0.777 . . . . 0.0 111.36 -175.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -137.29 56.26 1.79 Allowed 'General case' 0 C--O 1.236 0.384 0 N-CA-C 105.424 -2.065 . . . . 0.0 105.424 175.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.4 m -134.29 165.24 25.58 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.035 1.734 . . . . 0.0 106.412 -175.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -128.03 178.45 6.19 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.115 -0.991 . . . . 0.0 111.006 -175.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.19 151.35 24.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 122.732 0.413 . . . . 0.0 110.095 176.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -99.74 77.73 2.08 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 103.076 -2.935 . . . . 0.0 103.076 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -24.13 66.46 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.027 -1.463 . . . . 0.0 110.47 -175.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -66.46 -59.88 3.26 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 120.228 1.377 . . . . 0.0 109.799 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.62 93.15 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.979 0.912 . . . . 0.0 109.853 -178.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 62.5 m -66.78 -36.94 83.58 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.361 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 68.9 ttt-85 -63.7 -35.45 80.61 Favored 'General case' 0 C--N 1.345 0.405 0 CA-C-N 119.11 0.868 . . . . 0.0 109.111 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.47 -50.61 72.49 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.526 0.603 . . . . 0.0 109.965 -175.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.39 -44.88 77.82 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.435 0.294 . . . . 0.0 111.781 176.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -51.35 -39.3 56.77 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.646 1.178 . . . . 0.0 111.444 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -65.9 -42.41 90.24 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.399 0.68 . . . . 0.0 111.258 -178.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.3 mp -61.95 -54.87 35.77 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 123.428 0.691 . . . . 0.0 109.977 175.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 13.6 t -55.67 -36.18 41.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 122.83 0.452 . . . . 0.0 111.131 178.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -65.69 -38.25 88.74 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.129 176.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -76.2 123.18 25.45 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 120.166 1.348 . . . . 0.0 109.515 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -67.77 -19.53 65.11 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 121.338 -0.851 . . . . 0.0 111.289 175.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.88 -11.23 84.09 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.801 1.191 . . . . 0.0 112.538 176.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.8 t -74.13 143.24 45.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 175.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -72.37 -14.58 61.75 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.475 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.6 t -86.19 136.59 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 126.825 2.05 . . . . 0.0 109.12 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.53 -27.36 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.436 1.094 . . . . 0.0 110.127 175.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -130.91 154.2 48.35 Favored 'General case' 0 C--N 1.343 0.318 0 CA-C-N 119.836 1.198 . . . . 0.0 111.261 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.7 t -139.33 160.94 28.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 128.32 2.648 . . . . 0.0 107.542 176.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 45.1 p -122.41 153.7 38.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 175.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -123.29 123.94 41.86 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 175.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -106.46 175.98 5.32 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 105.222 -2.14 . . . . 0.0 105.222 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -115.06 152.41 32.55 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 175.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -147.59 124.2 11.1 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 53.24 -84.51 0.01 OUTLIER Glycine 0 CA--C 1.53 1.02 0 C-N-CA 126.003 1.764 . . . . 0.0 114.857 176.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.8 p -136.07 25.25 3.29 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.988 1.315 . . . . 0.0 112.009 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -145.7 169.81 17.73 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 119.177 0.899 . . . . 0.0 112.229 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.3 mm -96.48 138.38 21.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 104.282 -2.488 . . . . 0.0 104.282 175.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.3 m -130.79 147.89 67.96 Favored Pre-proline 0 CA--C 1.531 0.25 0 C-N-CA 122.822 0.449 . . . . 0.0 110.947 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.73 139.99 34.79 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 121.566 1.511 . . . . 0.0 108.457 175.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -110.67 -147.65 11.31 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 125.506 1.527 . . . . 0.0 109.793 176.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -59.28 160.3 6.72 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 123.763 0.825 . . . . 0.0 111.179 175.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -141.28 166.06 25.82 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 126.137 1.775 . . . . 0.0 108.641 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.27 179.41 41.38 Favored Glycine 0 N--CA 1.452 -0.291 0 O-C-N 121.593 -0.692 . . . . 0.0 113.033 -175.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -124.14 -12.8 7.37 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 125.559 1.544 . . . . 0.0 113.476 -175.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -131.98 144.82 51.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -83.5 -9.04 59.22 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.429 0.691 . . . . 0.0 110.518 -174.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -58.31 -37.02 74.24 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.327 -1.483 . . . . 0.0 110.219 175.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 19.4 m80 -76.04 -29.34 58.03 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.261 1.024 . . . . 0.0 110.549 175.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -60.51 -32.87 71.87 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 121.565 -0.71 . . . . 0.0 111.994 178.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.5 mm -57.6 -35.62 51.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.4 mm-40 -71.87 -23.57 61.53 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.287 1.435 . . . . 0.0 112.345 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -65.03 -34.62 78.87 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 120.842 -1.161 . . . . 0.0 110.688 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.63 112.86 19.21 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 -176.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.3 p -113.82 172.53 6.92 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.753 1.621 . . . . 0.0 112.66 -175.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -46.38 -71.36 0.07 Allowed 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 118.267 2.691 . . . . 0.0 118.267 -174.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -106.58 -31.34 8.54 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -175.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.8 m -70.88 153.3 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.95 0 O-C-N 120.991 -1.068 . . . . 0.0 110.896 -175.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.87 148.16 26.47 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 175.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.3 tp -145.93 162.98 36.55 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.478 1.111 . . . . 0.0 109.495 -175.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -128.16 152.51 47.95 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.427 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.96 143.89 29.78 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 118.34 0.518 . . . . 0.0 112.137 176.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -109.88 123.73 50.1 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 176.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.5 t -133.02 138.99 50.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 122.72 0.408 . . . . 0.0 111.564 -175.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -79.95 120.5 24.24 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 104.187 -2.523 . . . . 0.0 104.187 175.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -135.92 164.2 28.49 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 86.0 m -116.38 117.48 30.05 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 -176.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 3.3 m -152.04 158.42 43.03 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.12 164.78 7.32 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 125.081 1.324 . . . . 0.0 111.206 -178.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -142.67 155.17 44.88 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 123.626 0.77 . . . . 0.0 109.264 176.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.444 ' C ' ' H ' ' A' ' 74' ' ' SER . . . -146.35 -173.38 4.17 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.03 2.932 . . . . 0.0 105.516 176.147 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 86.7 mtp -65.88 7.17 0.29 Allowed 'General case' 0 CA--C 1.551 0.999 0 O-C-N 121.223 -0.923 . . . . 0.0 111.642 175.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.444 ' H ' ' C ' ' A' ' 72' ' ' ALA . 72.9 m -146.07 176.31 9.81 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 129.569 3.147 . . . . 0.0 106.633 175.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.5 mmpm? -77.23 175.56 9.58 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 119.828 -1.795 . . . . 0.0 110.188 175.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -136.72 161.28 36.37 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.169 0.987 . . . . 0.0 108.712 -175.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.8 t -144.58 123.75 12.92 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 175.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mtpt -132.06 123.39 27.13 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 -175.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -86.06 129.39 34.86 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.088 -175.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -104.04 126.02 50.84 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -94.78 113.31 25.06 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 102.759 -3.052 . . . . 0.0 102.759 175.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.8 mp -95.13 143.53 11.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.2 m -125.42 123.22 38.8 Favored 'General case' 0 N--CA 1.435 -1.203 0 N-CA-C 102.66 -3.089 . . . . 0.0 102.66 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -99.67 124.52 44.98 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 104.039 -2.578 . . . . 0.0 104.039 175.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.2 mt -139.2 78.62 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -42.75 137.53 3.39 Favored Glycine 0 C--N 1.339 0.725 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -176.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -62.19 -4.07 1.58 Allowed 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 118.369 1.085 . . . . 0.0 112.485 -175.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -83.12 -35.98 25.17 Favored 'General case' 0 CA--C 1.521 -0.153 0 O-C-N 120.402 -1.437 . . . . 0.0 109.889 178.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.9 p -78.35 123.73 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 119.889 1.222 . . . . 0.0 109.084 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.3 t -146.05 123.63 11.78 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 175.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 133.26 -151.11 19.99 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 124.254 0.931 . . . . 0.0 111.084 -175.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -50.4 -38.5 43.23 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 126.193 1.797 . . . . 0.0 111.656 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -61.38 -38.11 85.83 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.169 1.35 . . . . 0.0 111.484 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.0 ttm180 -71.47 -37.29 71.34 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.751 1.16 . . . . 0.0 108.322 175.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.48 -31.57 72.77 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 118.788 -0.625 . . . . 0.0 111.849 178.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -59.51 -54.27 48.47 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 119.457 1.026 . . . . 0.0 108.394 176.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.8 m -52.16 -40.97 62.18 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.573 0.624 . . . . 0.0 110.367 175.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -58.77 -25.83 59.45 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-O 119.736 -0.48 . . . . 0.0 113.768 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 50.8 m -115.16 -0.29 13.33 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.568 1.184 . . . . 0.0 111.657 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -103.49 -23.14 13.54 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.71 1.604 . . . . 0.0 108.775 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.504 ' HZ2' ' CG2' ' A' ' 116' ' ' VAL . 87.4 mttt -53.33 -24.43 11.87 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 120.111 1.323 . . . . 0.0 110.437 174.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -64.09 -41.99 97.09 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.246 -0.909 . . . . 0.0 110.639 176.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 12.4 mt -62.82 -62.23 1.87 Allowed 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 125.363 1.465 . . . . 0.0 109.007 -176.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.257 0.9 OUTLIER -57.45 -31.32 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 117.501 -1.237 . . . . 0.0 110.702 176.353 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -60.92 -47.58 85.74 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 121.195 1.816 . . . . 0.0 109.8 175.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -54.37 -24.01 17.88 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.089 0.956 . . . . 0.0 111.539 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 61.5 t -86.15 -65.38 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.653 1.181 . . . . 0.0 108.036 175.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 98.1 t -64.8 25.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.814 1 C-N-CA 131.957 4.103 . . . . 0.0 113.747 -175.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -49.42 -26.6 3.39 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 115.553 1.686 . . . . 0.0 115.553 -175.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -105.49 84.44 2.09 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -138.13 176.52 8.63 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 124.787 1.235 . . . . 0.0 108.293 176.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -104.65 -62.38 1.34 Allowed 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.31 0.644 . . . . 0.0 109.869 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -156.45 175.79 13.55 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 127.554 2.342 . . . . 0.0 106.879 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -117.31 170.58 8.59 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 125.024 1.33 . . . . 0.0 111.077 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -141.67 150.54 42.03 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 105.187 -2.153 . . . . 0.0 105.187 -176.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.504 ' CG2' ' HZ2' ' A' ' 101' ' ' LYS . 65.2 t -124.27 128.7 73.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 175.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.4 mp -129.13 142.15 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 125.562 1.545 . . . . 0.0 107.182 -178.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.6 p -135.13 -3.26 2.48 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 175.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -130.85 149.7 52.36 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.094 1.758 . . . . 0.0 109.652 -175.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 14.0 ttp85 -69.46 -30.64 68.58 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.608 -0.71 . . . . 0.0 111.125 -176.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -73.47 -39.01 65.24 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 120.232 1.378 . . . . 0.0 109.095 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -63.86 -23.7 67.46 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.127 0.971 . . . . 0.0 110.35 175.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -71.93 -22.35 61.48 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.741 -1.224 . . . . 0.0 112.571 176.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -61.28 123.81 18.8 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -176.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -56.12 -31.59 63.45 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.232 1.013 . . . . 0.0 113.462 175.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -55.48 -43.28 75.39 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -175.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -94.9 -25.87 16.39 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 119.82 1.191 . . . . 0.0 109.473 176.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 14.9 mt -51.98 -39.7 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 124.782 1.233 . . . . 0.0 107.995 176.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -51.46 -52.29 47.7 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.764 0.711 . . . . 0.0 110.64 175.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -68.23 -40.62 81.99 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.38 0.536 . . . . 0.0 110.583 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -61.47 -39.21 90.06 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.315 -0.866 . . . . 0.0 111.263 178.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.4 mt -73.08 -40.42 65.03 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.767 1.227 . . . . 0.0 110.314 176.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -56.8 -44.54 82.04 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 175.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.75 -49.23 77.24 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.339 1.055 . . . . 0.0 109.208 175.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.84 -22.62 64.4 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -177.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -56.78 -46.49 89.79 Favored Glycine 0 CA--C 1.529 0.958 0 O-C-N 121.305 -0.872 . . . . 0.0 112.745 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -75.19 92.05 0.84 Allowed Glycine 0 C--N 1.335 0.499 0 N-CA-C 108.827 -1.709 . . . . 0.0 108.827 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -158.33 164.66 36.16 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 118.328 1.064 . . . . 0.0 110.528 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -85.24 93.6 8.71 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.964 1.306 . . . . 0.0 110.088 177.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -155.2 116.33 3.97 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.904 2.082 . . . . 0.0 107.193 -176.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -131.59 157.93 42.34 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.069 1.748 . . . . 0.0 108.909 175.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -153.5 79.41 1.16 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.551 1.54 . . . . 0.0 109.503 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.6 mm-40 -70.65 40.68 0.06 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.984 2.114 . . . . 0.0 112.375 175.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 64.51 23.45 12.91 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.831 1.653 . . . . 0.0 110.507 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 125.136 1.374 . . . . 0.0 109.038 -176.323 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.065 0 CA-C-O 118.791 -1.005 . . . . 0.0 112.695 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.6 pt -144.59 62.34 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 125.528 1.531 . . . . 0.0 108.139 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.95 23.74 11.79 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 120.539 -1.351 . . . . 0.0 112.986 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -86.77 176.31 7.79 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.175 0.898 . . . . 0.0 109.966 175.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -138.99 95.85 3.02 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 104.194 -2.521 . . . . 0.0 104.194 175.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.0 m -134.17 178.47 6.94 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.081 1.352 . . . . 0.0 108.328 -175.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.3 tttp -127.35 175.45 8.18 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.197 -0.94 . . . . 0.0 111.58 -175.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -139.97 148.2 23.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 C-N-CA 125.993 1.717 . . . . 0.0 107.851 175.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -91.57 79.47 5.48 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 103.478 -2.786 . . . . 0.0 103.478 175.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -60.64 -23.47 64.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 116.92 -1.514 . . . . 0.0 113.577 -175.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.33 -56.79 4.31 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.813 1.642 . . . . 0.0 109.309 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.43 89.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 119.727 -0.178 . . . . 0.0 111.473 -175.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 100.0 m -72.08 -33.85 68.22 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.474 -0.766 . . . . 0.0 111.082 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -24.89 66.52 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 117.856 -1.069 . . . . 0.0 110.704 176.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.68 -59.07 5.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 120.387 1.449 . . . . 0.0 110.146 176.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.34 -39.01 91.7 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.651 -0.656 . . . . 0.0 111.216 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -55.92 -47.11 78.08 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 118.438 -0.792 . . . . 0.0 109.532 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -54.67 -47.15 73.96 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 124.971 1.308 . . . . 0.0 110.351 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.3 mp -60.11 -53.97 51.48 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 118.465 0.575 . . . . 0.0 111.088 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 40.4 t -65.02 -24.28 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 O-C-N 121.19 -0.944 . . . . 0.0 111.352 -178.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -51.59 10.48 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 125.321 1.448 . . . . 0.0 110.719 176.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.68 123.71 21.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.693 0.679 . . . . 0.0 112.442 -175.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -67.84 -9.17 42.26 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.874 0.87 . . . . 0.0 113.101 -176.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -91.43 -0.57 72.96 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 119.438 1.017 . . . . 0.0 112.491 176.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.5 t -80.79 145.46 31.45 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 119.055 1.428 . . . . 0.0 111.029 178.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -80.47 -35.84 34.26 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.0 127.81 27.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 C-N-CA 125.669 1.587 . . . . 0.0 108.264 176.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -115.75 -23.87 3.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 125.002 1.321 . . . . 0.0 110.991 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -124.98 143.34 50.94 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.594 1.158 . . . . 0.0 108.836 -177.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.7 t -137.16 165.25 28.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 127.647 2.379 . . . . 0.0 109.44 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 82.8 p -132.9 156.33 47.42 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.725 1.21 . . . . 0.0 108.125 175.274 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -128.43 124.47 36.32 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 176.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -99.88 176.32 5.48 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -115.85 145.1 43.15 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 104.939 -2.245 . . . . 0.0 104.939 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -133.58 123.52 25.26 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.218 -2.512 . . . . 0.0 104.218 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 36.48 -96.96 0.01 OUTLIER Glycine 0 CA--C 1.533 1.167 0 C-N-CA 126.469 1.985 . . . . 0.0 113.22 -175.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 p -120.18 35.34 4.89 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.681 1.592 . . . . 0.0 113.197 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -146.49 168.74 20.45 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.31 1.044 . . . . 0.0 111.239 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.2 mm -100.14 138.49 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 175.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.7 m -134.08 161.43 63.79 Favored Pre-proline 0 N--CA 1.473 0.706 0 C-N-CA 123.587 0.755 . . . . 0.0 111.688 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.96 155.93 66.94 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 121.896 1.73 . . . . 0.0 108.469 175.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.02 -144.98 7.13 Favored Glycine 0 CA--C 1.52 0.388 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 176.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -68.97 159.64 32.37 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 175.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -141.11 161.84 36.91 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 125.552 1.541 . . . . 0.0 107.349 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.49 -178.21 46.93 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-O 122.393 0.996 . . . . 0.0 113.155 176.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.97 -26.43 4.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.002 1.321 . . . . 0.0 110.313 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -94.9 123.26 38.26 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -83.12 -14.27 53.95 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.201 0.6 . . . . 0.0 110.599 -176.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -57.74 -38.06 74.67 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.561 -1.337 . . . . 0.0 110.065 175.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -68.68 -32.31 72.04 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.645 -0.659 . . . . 0.0 111.575 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -57.98 -31.92 67.38 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.479 1.112 . . . . 0.0 111.025 178.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 mm -63.97 -47.65 89.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -67.78 -23.62 65.23 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.897 0.879 . . . . 0.0 112.799 176.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -67.8 -25.86 65.8 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 119.975 1.261 . . . . 0.0 111.644 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 74.3 m -73.79 112.89 10.34 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.384 0.611 . . . . 0.0 109.654 -175.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.37 2.1 p -105.23 167.28 9.83 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 127.298 2.239 . . . . 0.0 111.437 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -54.12 -76.68 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 -174.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -100.76 -28.25 12.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 119.685 1.129 . . . . 0.0 113.574 -174.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.0 m -58.77 137.71 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 O-C-N 121.276 -0.89 . . . . 0.0 109.619 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.11 134.9 47.45 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 105.09 -2.189 . . . . 0.0 105.09 175.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.8 tp -130.19 161.99 29.9 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 124.684 1.194 . . . . 0.0 109.801 -175.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -120.52 140.83 50.88 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 175.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.458 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -130.44 146.16 51.95 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 124.01 0.924 . . . . 0.0 108.856 176.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -123.74 123.62 40.91 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 103.562 -2.755 . . . . 0.0 103.562 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 t -138.07 146.61 26.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 118.917 0.781 . . . . 0.0 110.414 -175.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 20.2 ttm180 -79.69 123.99 28.16 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -128.82 170.75 12.99 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.917 1.287 . . . . 0.0 109.183 176.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 90.6 m -119.33 115.32 23.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 125.106 1.362 . . . . 0.0 107.864 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.9 m -151.83 141.99 22.28 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.346 -0.846 . . . . 0.0 110.645 176.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 87.61 157.18 31.14 Favored Glycine 0 CA--C 1.525 0.67 0 C-N-CA 126.116 1.817 . . . . 0.0 108.575 -177.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -135.77 141.16 44.77 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -176.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.47 -173.35 4.17 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 127.343 2.257 . . . . 0.0 106.942 175.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 58.4 mmm -64.94 -6.22 7.96 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.037 0.535 . . . . 0.0 111.28 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.4 m -132.52 166.92 20.96 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 129.61 3.164 . . . . 0.0 105.902 175.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -71.12 175.91 4.87 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 122.36 1.076 . . . . 0.0 108.937 175.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -132.52 150.21 52.19 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 175.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.1 t -125.12 128.92 49.18 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 103.511 -2.774 . . . . 0.0 103.511 175.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -136.08 123.91 22.6 Favored 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -177.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -91.6 128.11 37.3 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.589 -175.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -103.62 121.57 43.2 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 -176.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.79 113.37 23.39 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 105.048 -2.205 . . . . 0.0 105.048 175.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.0 mp -96.15 138.86 20.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 176.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -122.68 123.29 40.79 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 104.269 -2.493 . . . . 0.0 104.269 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 63.8 t-105 -92.13 123.33 35.4 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 104.224 -2.51 . . . . 0.0 104.224 175.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.0 mt -150.16 92.06 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 176.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -57.63 174.97 2.01 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 123.933 0.778 . . . . 0.0 113.183 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -86.51 -9.24 56.59 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.47 -1.018 . . . . 0.0 110.67 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -83.86 -31.74 25.61 Favored 'General case' 0 C--O 1.238 0.475 0 O-C-N 121.022 -1.049 . . . . 0.0 109.142 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -65.7 146.39 13.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 118.73 0.695 . . . . 0.0 110.739 -177.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 39.9 t -74.62 151.78 39.31 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 125.602 1.561 . . . . 0.0 110.812 -177.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.2 -28.87 69.82 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 123.907 0.765 . . . . 0.0 111.469 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.2 tt -62.39 -47.96 81.81 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 118.284 1.042 . . . . 0.0 109.653 176.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -65.46 -46.47 79.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.697 -0.668 . . . . 0.0 109.853 175.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.01 -27.9 61.99 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.45 1.023 . . . . 0.0 111.82 177.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.64 -36.68 85.03 Favored 'General case' 0 C--O 1.234 0.272 0 O-C-N 120.7 -1.25 . . . . 0.0 112.104 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -57.02 -46.42 82.37 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 118.641 -0.695 . . . . 0.0 109.515 176.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.2 m -55.38 -42.46 74.0 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 123.66 0.784 . . . . 0.0 109.781 -177.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -70.66 -26.35 74.21 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 119.195 0.907 . . . . 0.0 113.135 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 86.0 m -86.05 -15.95 39.67 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.768 1.227 . . . . 0.0 111.419 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -103.5 -23.73 13.49 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 127.458 2.303 . . . . 0.0 113.225 -175.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -50.0 -27.91 6.16 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.29 1.405 . . . . 0.0 113.004 176.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.2 t -62.88 -38.64 91.68 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.499 1.045 . . . . 0.0 112.072 176.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 12.4 mt -65.17 -61.33 2.2 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 125.419 1.488 . . . . 0.0 109.658 -176.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.257 0.8 OUTLIER -58.63 -28.96 38.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-O 118.117 -0.944 . . . . 0.0 109.262 175.636 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.01 -39.52 94.3 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 120.534 1.515 . . . . 0.0 109.653 175.503 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -54.52 -32.37 58.01 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 120.19 1.359 . . . . 0.0 112.988 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 52.5 t -86.44 -60.01 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 125.123 1.369 . . . . 0.0 111.022 176.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 3.5 t -74.32 26.62 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 129.193 2.997 . . . . 0.0 113.545 -175.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -53.61 -13.58 0.68 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 120.183 -1.573 . . . . 0.0 114.169 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -94.99 29.43 2.41 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.113 1.324 . . . . 0.0 113.08 175.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.37 174.12 9.32 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 175.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -123.69 -45.62 2.03 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.672 -0.642 . . . . 0.0 110.974 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.72 175.6 8.67 Favored 'General case' 0 C--O 1.235 0.29 1 C-N-CA 131.842 4.057 . . . . 0.0 106.333 175.811 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -132.1 171.4 13.68 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.82 0.848 . . . . 0.0 111.267 -178.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -146.85 149.98 34.35 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 40.3 t -123.62 124.22 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 175.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.7 mt -122.12 146.01 27.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 125.701 1.6 . . . . 0.0 109.521 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 12.8 p -140.08 -8.45 1.18 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.493 1.294 . . . . 0.0 114.493 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -137.41 154.4 49.97 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.743 1.156 . . . . 0.0 109.32 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 29.1 ttp-105 -50.6 -46.53 58.01 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 124.165 0.986 . . . . 0.0 110.733 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -63.45 -38.19 90.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 118.587 0.63 . . . . 0.0 110.295 -176.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -72.62 -23.92 61.0 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.81 1.244 . . . . 0.0 110.491 177.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -79.57 -23.72 42.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.923 1.689 . . . . 0.0 111.527 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -69.77 123.56 21.74 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.099 1.318 . . . . 0.0 110.543 -176.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.1 -13.87 14.03 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.813 1.245 . . . . 0.0 113.717 -178.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -56.09 -65.93 0.52 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.363 1.865 . . . . 0.0 112.802 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -77.34 -25.86 51.49 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 118.263 -1.375 . . . . 0.0 108.815 -175.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 19.5 mt -50.21 -41.17 18.46 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 C-N-CA 125.569 1.548 . . . . 0.0 108.444 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 33.4 mttp -55.95 -56.33 21.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.582 -0.723 . . . . 0.0 111.054 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 43.4 t -67.76 -33.27 74.53 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.613 1.097 . . . . 0.0 110.754 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -60.86 -52.79 63.56 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.583 1.083 . . . . 0.0 109.791 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.8 mt -59.87 -41.05 90.67 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 124.656 1.183 . . . . 0.0 111.125 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -62.55 -52.58 62.87 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 123.645 0.778 . . . . 0.0 110.804 176.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -61.61 -45.84 92.35 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 119.331 0.969 . . . . 0.0 109.182 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.73 -0.03 6.36 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.508 1.123 . . . . 0.0 111.693 175.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -59.94 -26.37 63.03 Favored Glycine 0 CA--C 1.527 0.811 0 O-C-N 120.586 -1.321 . . . . 0.0 111.433 176.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -110.32 90.14 0.57 Allowed Glycine 0 C--N 1.337 0.602 0 N-CA-C 107.949 -2.06 . . . . 0.0 107.949 175.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -145.71 109.97 4.97 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 105.477 -2.045 . . . . 0.0 105.477 175.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -145.69 103.61 3.8 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -176.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -135.15 101.41 4.85 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.506 1.522 . . . . 0.0 110.32 -175.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.98 165.63 18.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.464 1.906 . . . . 0.0 110.479 175.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -144.82 136.14 25.21 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 127.022 2.129 . . . . 0.0 108.941 -178.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -127.55 94.64 4.02 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.544 1.065 . . . . 0.0 110.029 176.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.6 m 57.43 38.21 28.16 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.378 1.071 . . . . 0.0 111.016 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 . . . . . 0 C--O 1.248 1.012 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 175.427 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.217 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.8 pp -135.81 152.95 31.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-N 117.981 0.891 . . . . 0.0 111.022 -172.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 63.1 ttt-85 -150.96 166.65 29.99 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 106.166 -1.79 . . . . 0.0 106.166 175.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -67.53 24.78 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 127.058 2.143 . . . . 0.0 115.052 -175.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -122.76 43.99 2.77 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 123.195 1.474 . . . . 0.0 110.865 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.7 m -89.85 162.51 15.44 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 125.522 1.529 . . . . 0.0 107.868 176.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -133.45 -172.01 2.85 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 120.962 -1.086 . . . . 0.0 111.202 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.18 151.78 29.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 125.409 1.484 . . . . 0.0 108.964 175.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -86.7 79.0 9.0 Favored 'General case' 0 N--CA 1.464 0.272 1 N-CA-C 99.399 -4.297 . . . . 0.0 99.399 174.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.9 pttm -54.05 -35.4 61.97 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -74.49 -44.03 53.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 119.372 0.987 . . . . 0.0 109.469 -175.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.67 -45.86 73.99 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 118.13 0.423 . . . . 0.0 111.537 176.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 84.8 m -69.88 -41.6 74.56 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 119.382 -0.342 . . . . 0.0 110.574 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 -64.39 -32.29 73.85 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 116.631 -1.652 . . . . 0.0 109.777 175.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.87 -53.64 52.99 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 120.69 1.586 . . . . 0.0 110.029 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.23 -47.37 78.59 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.976 0.807 . . . . 0.0 110.98 176.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -55.54 -44.04 76.37 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.137 0.426 . . . . 0.0 111.005 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.54 -46.89 88.51 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 125.429 1.492 . . . . 0.0 109.612 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.2 mp -60.72 -46.57 89.88 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.789 0.722 . . . . 0.0 110.163 175.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.75 -39.38 81.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 123.598 0.759 . . . . 0.0 110.301 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -48.55 78.22 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -54.41 135.72 44.91 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 123.024 1.392 . . . . 0.0 113.032 -175.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -86.03 -22.69 27.12 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.679 1.992 . . . . 0.0 110.297 -178.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.35 -8.15 86.69 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.005 0.812 . . . . 0.0 112.947 176.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.7 t -81.21 139.62 35.41 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 118.653 1.226 . . . . 0.0 108.815 176.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -76.8 -35.65 57.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.311 0.644 . . . . 0.0 110.206 175.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.3 t -57.07 133.22 21.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 124.174 0.99 . . . . 0.0 108.935 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.09 -24.41 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 123.217 0.607 . . . . 0.0 109.656 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 49.3 p-90 -130.31 145.99 51.84 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 119.897 1.226 . . . . 0.0 110.366 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 49.9 t -137.28 168.42 21.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 175.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 76.5 p -132.02 161.01 34.23 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 175.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -135.19 123.9 23.77 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.76 -2.311 . . . . 0.0 104.76 -177.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -99.17 175.85 5.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 106.722 -1.585 . . . . 0.0 106.722 -176.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.448 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 24.0 m-85 -119.85 139.19 52.76 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 177.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -140.21 123.16 16.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 47.23 -98.47 0.01 OUTLIER Glycine 0 CA--C 1.526 0.768 0 C-N-CA 125.043 1.306 . . . . 0.0 113.818 -176.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 p -120.6 25.15 9.93 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.86 2.464 . . . . 0.0 111.745 -175.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -149.34 166.27 29.51 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.448 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 36.4 mm -92.88 133.1 35.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 175.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.7 m -126.7 160.95 55.97 Favored Pre-proline 0 N--CA 1.468 0.457 0 C-N-CA 123.406 0.682 . . . . 0.0 110.741 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.21 167.37 26.99 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 121.463 1.442 . . . . 0.0 109.11 175.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -139.23 -140.58 3.97 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.222 1.392 . . . . 0.0 112.13 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -66.86 156.42 35.73 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 126.749 2.02 . . . . 0.0 110.228 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -149.29 158.27 44.03 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 125.02 1.328 . . . . 0.0 110.14 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -173.39 174.68 46.12 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 123.91 0.767 . . . . 0.0 112.672 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.77 -8.9 7.85 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.72 1.608 . . . . 0.0 112.686 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.22 135.1 55.19 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 104.278 -2.49 . . . . 0.0 104.278 177.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.401 ' CE1' ' CD2' ' A' ' 51' ' ' PHE . 41.0 t80 -86.29 -14.67 43.0 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -175.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -55.28 -44.86 76.07 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.474 1.488 . . . . 0.0 109.532 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -62.68 -22.97 66.88 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.256 1.022 . . . . 0.0 112.028 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.401 ' CD2' ' CE1' ' A' ' 48' ' ' TYR . 0.7 OUTLIER -62.51 -55.54 26.53 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.766 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.02 -33.52 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.138 0.575 . . . . 0.0 109.815 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -62.49 -48.18 80.7 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -74.17 -22.43 59.42 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 -175.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 86.9 m -51.57 119.97 4.69 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 121.481 1.946 . . . . 0.0 110.727 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 p -101.54 164.18 11.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.458 1.503 . . . . 0.0 113.178 -175.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -49.77 -70.58 0.08 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 130.658 3.583 . . . . 0.0 119.251 -174.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -106.53 -36.49 6.75 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 124.845 1.258 . . . . 0.0 114.217 -175.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.6 m -58.39 145.36 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 CA-C-O 122.432 1.111 . . . . 0.0 110.397 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.72 139.64 38.69 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 175.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.4 tp -141.38 160.0 41.05 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -126.55 123.52 37.9 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 105.057 -2.201 . . . . 0.0 105.057 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -104.45 162.23 13.42 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 175.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -137.25 123.15 20.12 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 102.188 -3.264 . . . . 0.0 102.188 178.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.8 t -129.21 134.52 63.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -175.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 41.2 ttt85 -77.1 113.54 14.94 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 105.115 -2.18 . . . . 0.0 105.115 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -116.64 173.77 6.44 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 126.368 1.867 . . . . 0.0 108.963 -175.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 37.0 m -133.52 117.14 16.79 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 121.278 -0.889 . . . . 0.0 109.887 -176.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 m -156.44 155.46 32.12 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 93.23 113.63 2.25 Favored Glycine 0 CA--C 1.501 -0.822 0 N-CA-C 105.121 -3.192 . . . . 0.0 105.121 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -109.95 122.5 47.7 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 110.62 -2.79 . . . . 0.0 108.461 -175.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.404 ' C ' ' H ' ' A' ' 74' ' ' SER . . . -146.58 -173.79 4.3 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 126.047 1.739 . . . . 0.0 108.108 177.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 54.8 mtt -61.21 -1.21 0.44 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.131 1.772 . . . . 0.0 111.709 175.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.404 ' H ' ' C ' ' A' ' 72' ' ' ALA . 68.8 m -145.93 147.89 32.22 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 128.011 2.524 . . . . 0.0 105.366 175.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -69.26 167.05 17.14 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -138.44 167.9 20.91 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -177.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.3 t -125.58 158.37 34.8 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 175.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.5 mmmt -144.22 171.78 13.83 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 127.048 2.139 . . . . 0.0 107.475 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -144.53 123.88 13.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.532 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.94 129.24 56.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 126.054 1.742 . . . . 0.0 108.432 -176.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -98.57 113.8 25.99 Favored 'General case' 0 C--O 1.222 -0.342 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 175.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.1 mt -103.63 137.57 31.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 -177.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -116.05 122.89 46.51 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 175.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.0 t-105 -97.04 123.29 40.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 103.833 -2.654 . . . . 0.0 103.833 175.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.405 HD13 ' HE ' ' A' ' 94' ' ' ARG . 19.1 mt -145.56 98.12 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -59.94 162.86 16.18 Favored Glycine 0 CA--C 1.53 0.992 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -76.08 -6.41 51.0 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 121.07 -1.253 . . . . 0.0 110.998 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -83.2 -35.98 25.03 Favored 'General case' 0 C--N 1.341 0.231 0 O-C-N 121.423 -0.798 . . . . 0.0 109.589 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.7 p -71.56 127.62 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 176.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 48.3 t -63.32 153.44 34.94 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 124.28 1.032 . . . . 0.0 110.805 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -51.28 -29.94 23.71 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 125.678 1.608 . . . . 0.0 113.054 176.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.95 -51.66 69.11 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.355 1.078 . . . . 0.0 110.232 176.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -70.28 -31.49 68.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 118.51 -0.757 . . . . 0.0 110.036 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.405 ' HE ' HD13 ' A' ' 85' ' ' ILE . 6.7 ttt180 -63.41 -28.84 70.25 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.757 1.162 . . . . 0.0 109.273 175.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.89 -24.13 61.91 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.569 1.148 . . . . 0.0 111.958 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.36 -35.4 69.9 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 118.787 0.721 . . . . 0.0 110.481 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.7 m -54.8 -33.35 61.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.345 1.058 . . . . 0.0 110.146 175.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.33 -14.27 61.67 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 125.547 1.546 . . . . 0.0 114.481 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 30.0 m -123.18 -3.87 8.48 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.462 1.631 . . . . 0.0 109.894 175.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -103.79 -37.97 7.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 123.919 0.888 . . . . 0.0 112.684 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.5 mtmp? -57.18 -36.9 71.37 Favored 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 120.257 1.39 . . . . 0.0 111.376 -176.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -56.87 -34.06 67.46 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 120.255 1.388 . . . . 0.0 112.046 177.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 39.9 mt -66.21 -65.17 0.71 Allowed 'General case' 0 CA--C 1.508 -0.653 0 C-N-CA 125.887 1.675 . . . . 0.0 109.137 -176.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.1 p -57.73 -32.96 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-O 117.846 -1.073 . . . . 0.0 108.519 175.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -67.48 -24.31 65.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 121.144 1.793 . . . . 0.0 111.32 178.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.68 -27.22 66.66 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.92 1.236 . . . . 0.0 110.302 175.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 89.4 t -85.73 -56.68 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 175.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.1 t -70.09 17.35 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 130.17 3.388 . . . . 0.0 112.278 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -57.49 -26.71 61.7 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 119.406 -2.059 . . . . 0.0 111.027 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -94.9 72.35 3.48 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 125.247 1.419 . . . . 0.0 107.521 176.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -143.79 176.21 9.42 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.521 0.728 . . . . 0.0 110.209 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.68 -66.15 0.94 Allowed 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.772 0.829 . . . . 0.0 111.549 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -155.49 176.27 12.81 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.376 2.27 . . . . 0.0 111.778 -175.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -122.95 163.86 19.59 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.975 0.91 . . . . 0.0 111.212 175.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -138.67 147.75 43.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 -175.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.5 t -118.27 123.32 71.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 3.0 mt -132.44 143.27 40.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -176.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 7.7 p -143.24 -0.59 1.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.566 1.146 . . . . 0.0 112.679 -176.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -139.24 157.03 46.63 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.053 1.741 . . . . 0.0 108.846 -175.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -73.54 -41.67 62.68 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.823 -176.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -62.55 -34.37 76.81 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 120.136 1.335 . . . . 0.0 109.429 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -65.48 -23.3 66.87 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.785 1.634 . . . . 0.0 110.768 175.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -86.44 -23.53 26.0 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.657 1.183 . . . . 0.0 113.888 -176.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -57.15 123.84 16.67 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.711 1.204 . . . . 0.0 110.753 -176.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.97 -23.82 66.63 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.518 ' HA ' ' CE ' ' A' ' 129' ' ' LYS 0.356 10.5 t70 -57.69 -52.16 66.59 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 121.454 1.934 . . . . 0.0 113.526 -175.437 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -74.35 -23.15 58.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 116.821 -1.952 . . . . 0.0 109.019 -177.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 56.6 mt -55.78 -41.8 67.43 Favored 'Isoleucine or valine' 0 C--N 1.347 0.473 0 CA-C-N 119.283 0.947 . . . . 0.0 108.519 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.518 ' CE ' ' HA ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -54.73 -51.23 66.29 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 119.91 1.232 . . . . 0.0 111.434 175.588 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.9 t -71.25 -31.39 67.48 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.058 -175.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 36.1 tp10 -63.93 -46.51 84.46 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.612 1.165 . . . . 0.0 108.798 175.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 91.2 mt -66.18 -31.01 71.59 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.555 -0.716 . . . . 0.0 110.412 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? -65.98 -49.13 68.92 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.488 1.04 . . . . 0.0 108.317 175.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 39.9 mtmt -56.46 -45.06 81.04 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.824 0.738 . . . . 0.0 110.117 176.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.6 1.63 3.03 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.358 1.463 . . . . 0.0 114.029 176.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -146.83 -103.94 0.37 Allowed Glycine 0 C--N 1.335 0.496 0 N-CA-C 108.413 -1.875 . . . . 0.0 108.413 176.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.28 173.96 43.46 Favored Glycine 0 CA--C 1.526 0.72 0 C-N-CA 123.969 0.795 . . . . 0.0 111.17 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -159.5 -178.11 6.89 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.557 2.343 . . . . 0.0 106.66 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -127.2 65.18 1.31 Allowed 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 175.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -145.29 112.78 6.23 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.095 -2.187 . . . . 0.0 105.095 -176.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -145.92 171.08 15.35 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 129.17 2.988 . . . . 0.0 103.297 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -148.24 136.24 21.05 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 121.349 1.886 . . . . 0.0 114.167 -175.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -83.31 25.78 0.7 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.493 1.917 . . . . 0.0 110.112 175.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 86.43 56.57 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 128.639 2.776 . . . . 0.0 106.012 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 . . . . . 0 C--O 1.249 1.029 0 C-N-CA 129.018 2.927 . . . . 0.0 105.427 -176.1 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.632 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.5 mp -143.22 145.09 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.27 125.17 38.33 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 175.587 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.96 151.31 44.07 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 118.71 0.686 . . . . 0.0 110.53 -176.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -101.51 64.1 0.99 Allowed 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.2 m -143.05 166.44 24.63 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.065 1.746 . . . . 0.0 106.805 -175.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.5 tttm -130.14 -178.66 4.83 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 124.137 0.975 . . . . 0.0 109.799 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.56 147.81 28.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 176.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -89.91 73.06 7.47 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 175.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -31.6 69.84 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-O 118.108 -0.949 . . . . 0.0 109.649 -176.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -63.74 -56.85 12.48 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.26 0.936 . . . . 0.0 109.394 -177.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.18 -43.27 82.6 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 122.27 -0.268 . . . . 0.0 110.846 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 79.9 m -68.91 -28.14 66.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.436 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -61.5 -38.86 88.86 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.527 176.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.44 -56.3 23.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 119.358 0.981 . . . . 0.0 109.771 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.06 -42.93 99.42 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.862 -0.524 . . . . 0.0 111.268 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.471 ' HH ' ' ND2' ' A' ' 110' ' ' ASN . 4.5 t80 -53.34 -48.48 68.45 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 175.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -61.56 -47.01 87.45 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 124.93 1.292 . . . . 0.0 110.348 -176.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -63.74 -27.39 69.17 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.6 t -83.53 -33.27 9.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 118.889 0.768 . . . . 0.0 109.948 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -70.56 -44.69 66.89 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.493 1.917 . . . . 0.0 111.743 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -70.83 123.49 22.1 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.646 1.578 . . . . 0.0 113.162 -175.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -72.21 -11.83 60.9 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.705 0.802 . . . . 0.0 110.217 175.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.74 -26.6 62.47 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 125.514 1.531 . . . . 0.0 111.705 175.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.2 t -85.92 150.24 24.64 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.915 1.686 . . . . 0.0 108.709 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.93 -14.58 44.3 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.215 0.606 . . . . 0.0 111.723 175.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.6 t -70.53 133.54 31.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -176.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.31 -24.06 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 118.456 -0.783 . . . . 0.0 111.44 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 55.0 p-90 -131.61 153.15 50.22 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 120.014 1.279 . . . . 0.0 110.83 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.7 t -140.86 164.37 21.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 129.663 3.185 . . . . 0.0 109.122 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 39.2 p -128.82 158.56 38.36 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.366 1.466 . . . . 0.0 107.883 175.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -133.56 123.69 25.58 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.5 mtpt -99.63 176.9 5.32 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 175.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -117.53 144.13 45.39 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 175.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -142.83 156.47 44.95 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 175.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 35.92 -104.7 0.03 OUTLIER Glycine 0 CA--C 1.53 0.992 0 C-N-CA 125.742 1.639 . . . . 0.0 112.065 -175.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.6 p -129.89 41.96 3.35 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 127.443 2.297 . . . . 0.0 109.456 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.9 t -149.55 172.73 14.54 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.113 0.965 . . . . 0.0 112.349 -175.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.5 mm -99.62 140.03 19.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 175.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.7 m -129.85 156.57 78.76 Favored Pre-proline 0 N--CA 1.469 0.514 0 C-N-CA 123.436 0.694 . . . . 0.0 110.551 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -71.46 154.35 60.57 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.812 1.674 . . . . 0.0 109.98 175.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -126.28 -158.21 9.82 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 125.738 1.637 . . . . 0.0 109.703 176.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -53.17 157.55 1.83 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 126.607 1.963 . . . . 0.0 111.468 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.2 pm0 -144.57 169.86 17.17 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.269 1.428 . . . . 0.0 109.885 177.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -172.61 166.47 39.16 Favored Glycine 0 CA--C 1.522 0.48 0 CA-C-O 122.222 0.901 . . . . 0.0 112.76 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -99.23 -18.51 17.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.239 1.416 . . . . 0.0 110.548 175.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -129.2 139.02 52.03 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 176.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.419 ' CE1' ' CD2' ' A' ' 51' ' ' PHE . 53.8 t80 -83.82 -5.18 59.15 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.633 1.973 . . . . 0.0 113.077 -175.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -57.72 -36.85 72.58 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 120.62 -1.3 . . . . 0.0 110.958 176.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -65.77 -39.9 91.49 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.943 0.897 . . . . 0.0 110.504 176.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.419 ' CD2' ' CE1' ' A' ' 48' ' ' TYR . 33.2 t80 -56.97 -34.94 68.57 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 125.223 1.409 . . . . 0.0 112.029 -176.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 mm -60.03 -35.75 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 24.8 mm100 -85.86 -24.15 26.81 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.429 1.492 . . . . 0.0 112.457 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -67.48 -24.66 65.62 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 118.942 0.792 . . . . 0.0 111.467 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 78.0 m -75.21 113.42 12.54 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.311 2.1 p -92.89 171.23 9.1 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.595 1.558 . . . . 0.0 112.667 -175.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.445 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 2.7 p-10 -47.21 -74.65 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 118.118 2.636 . . . . 0.0 118.118 -174.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.445 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 1.8 t70 -107.51 -35.62 6.7 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 127.323 2.249 . . . . 0.0 115.965 -174.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.4 m -54.93 155.53 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 N-CA-C 114.714 1.376 . . . . 0.0 114.714 -175.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 26.7 ptt-85 -103.99 135.32 45.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.6 tp -142.74 165.71 26.64 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 125.989 1.716 . . . . 0.0 107.249 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -131.41 154.55 48.53 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -136.45 151.97 50.07 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 123.581 0.752 . . . . 0.0 111.222 176.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -123.46 123.57 40.95 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 104.191 -2.522 . . . . 0.0 104.191 175.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.9 t -130.36 139.27 51.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 122.866 0.467 . . . . 0.0 109.879 -175.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -86.8 126.61 34.73 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 106.179 -1.785 . . . . 0.0 106.179 175.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -136.11 168.36 19.52 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -175.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m -127.13 114.22 17.43 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 120.717 -1.239 . . . . 0.0 108.066 175.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 m -144.17 147.39 33.61 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 105.78 118.57 4.45 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 125.274 1.416 . . . . 0.0 110.997 175.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -77.67 121.86 24.55 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 124.669 1.188 . . . . 0.0 108.068 -177.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.26 173.25 12.4 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 125.25 1.42 . . . . 0.0 108.836 175.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 93.7 mtp -73.35 3.63 5.67 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.809 0.843 . . . . 0.0 111.379 175.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.3 m -143.28 168.79 18.97 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 128.288 2.635 . . . . 0.0 106.821 176.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -67.13 165.45 15.92 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -133.31 153.96 51.12 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 105.667 -1.975 . . . . 0.0 105.667 175.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 t -129.59 123.93 32.53 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 176.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 49.5 mttt -132.49 145.54 51.25 Favored 'General case' 0 CA--C 1.503 -0.864 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -114.65 144.68 43.04 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.439 -0.8 . . . . 0.0 108.981 -175.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -116.24 121.22 41.4 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 -178.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -91.02 113.36 25.6 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 102.251 -3.24 . . . . 0.0 102.251 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -103.05 143.93 14.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -122.43 123.53 41.53 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 104.737 -2.32 . . . . 0.0 104.737 175.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.8 t-105 -100.78 124.03 45.83 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 104.033 -2.58 . . . . 0.0 104.033 175.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.2 mm -127.12 98.62 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 175.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -44.22 126.85 6.38 Favored Glycine 0 C--N 1.342 0.867 0 N-CA-C 107.008 -2.437 . . . . 0.0 107.008 176.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -54.5 -7.64 0.17 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 -175.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -83.56 -35.87 24.41 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.755 1.622 . . . . 0.0 112.454 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.4 p -75.07 135.75 26.58 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 CA-C-N 121.029 1.74 . . . . 0.0 111.62 -175.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.0 t -146.4 176.7 9.59 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.821 1.248 . . . . 0.0 108.909 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 81.05 -142.58 23.37 Favored Glycine 0 CA--C 1.521 0.443 0 O-C-N 121.654 -0.654 . . . . 0.0 113.062 175.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 9.2 tt -53.18 -44.66 68.09 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 124.791 1.237 . . . . 0.0 110.578 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -60.83 -35.55 76.82 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.115 0.566 . . . . 0.0 110.953 -177.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.8 ttt-85 -70.7 -44.56 66.7 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.209 -0.932 . . . . 0.0 108.542 175.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.69 68.87 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.184 0.594 . . . . 0.0 112.444 177.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -58.62 -54.71 44.0 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 175.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.0 m -51.7 -45.67 63.59 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 119.513 1.051 . . . . 0.0 109.974 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -60.4 -25.88 63.43 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-O 119.91 -0.383 . . . . 0.0 113.729 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.8 m -101.4 -9.83 20.77 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.058 1.743 . . . . 0.0 111.232 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -103.84 -23.81 13.36 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 126.134 1.773 . . . . 0.0 112.462 -175.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 42.1 mtpt -54.25 -31.84 54.53 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.466 1.484 . . . . 0.0 112.035 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 5.4 t -66.84 -29.4 69.31 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.288 0.949 . . . . 0.0 112.226 175.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 10.7 mt -68.21 -63.55 1.04 Allowed 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 125.169 1.388 . . . . 0.0 108.758 -176.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.36 -29.02 41.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 118.04 -0.981 . . . . 0.0 108.741 175.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.6 tttp -65.82 -27.34 68.18 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 120.87 1.668 . . . . 0.0 110.72 175.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -65.02 -27.51 68.86 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 121.224 1.829 . . . . 0.0 111.107 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 72.8 t -85.71 -48.87 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 175.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 65.6 t -84.46 26.07 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 128.796 2.838 . . . . 0.0 111.15 -175.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -56.93 -26.32 59.23 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 121.246 1.839 . . . . 0.0 110.942 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.471 ' ND2' ' HH ' ' A' ' 17' ' ' TYR . 3.1 t30 -90.08 80.66 6.3 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.954 1.702 . . . . 0.0 106.867 175.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -148.6 176.31 10.44 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 175.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.42 -64.69 1.26 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.899 0.88 . . . . 0.0 111.789 -175.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -132.03 172.32 12.51 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.353 1.461 . . . . 0.0 110.366 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -125.89 164.54 20.52 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.757 1.223 . . . . 0.0 108.234 175.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -150.96 146.07 26.01 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 103.831 -2.655 . . . . 0.0 103.831 -175.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.7 t -122.98 123.82 68.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 3.3 mt -129.41 150.82 34.99 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 125.459 1.504 . . . . 0.0 108.76 -175.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.0 p -151.27 0.34 0.38 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.34 1.056 . . . . 0.0 113.804 177.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.452 ' OD1' ' HE2' ' A' ' 121' ' ' LYS . 5.0 t70 -126.03 145.87 50.13 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.15 1.38 . . . . 0.0 108.906 -175.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 45.4 ttt85 -65.46 -33.93 77.08 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.452 ' HE2' ' OD1' ' A' ' 119' ' ' ASP . 7.4 mtmm -68.78 -45.64 70.8 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 120.125 1.33 . . . . 0.0 108.169 175.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.02 -23.77 62.25 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.466 1.907 . . . . 0.0 111.596 -179.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -78.16 -22.85 48.09 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.571 1.948 . . . . 0.0 113.782 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -69.99 129.84 40.57 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.562 1.528 . . . . 0.0 113.592 -176.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -57.92 -25.79 61.35 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.082 1.353 . . . . 0.0 113.715 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -53.61 -55.04 29.24 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 123.869 0.868 . . . . 0.0 112.495 -176.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -86.37 -23.86 26.02 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 118.517 -1.273 . . . . 0.0 109.029 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 64.4 mt -55.06 -40.13 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 175.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -52.14 -54.27 32.66 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.977 0.808 . . . . 0.0 110.012 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.2 t -69.0 -36.03 77.36 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.957 -0.544 . . . . 0.0 111.27 -177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -64.3 -39.46 93.97 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.991 1.269 . . . . 0.0 110.054 176.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 67.5 mt -69.78 -30.52 68.1 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 120.94 -1.1 . . . . 0.0 110.1 175.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 8.0 mtmp? -67.25 -45.94 75.22 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -57.21 -55.78 30.27 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.0 -25.98 46.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.407 1.083 . . . . 0.0 111.811 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -76.42 83.08 1.01 Allowed Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 175.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 117.91 -18.87 11.37 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 125.729 1.633 . . . . 0.0 112.837 177.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.86 99.83 1.1 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.415 1.108 . . . . 0.0 110.629 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -124.55 110.02 13.95 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -134.77 97.33 3.74 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -147.12 81.81 1.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -141.35 136.56 31.6 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 124.107 0.963 . . . . 0.0 110.772 -175.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -133.43 148.2 51.76 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 124.525 1.13 . . . . 0.0 109.135 176.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.0 m 59.01 23.49 11.63 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.036 1.734 . . . . 0.0 110.598 177.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 . . . . . 0 C--O 1.256 1.417 0 C-N-CA 128.284 2.634 . . . . 0.0 107.624 -177.983 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.707 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.8 tp -153.45 113.37 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 117.994 0.897 . . . . 0.0 108.712 175.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -83.67 113.97 21.24 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -177.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 9.5 ptm -149.77 175.5 11.54 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.141 0.577 . . . . 0.0 110.491 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -147.87 65.84 1.11 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.75 1.22 . . . . 0.0 109.47 175.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.0 m -121.99 176.1 5.97 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.215 1.806 . . . . 0.0 106.575 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -137.86 -179.22 5.64 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.733 -1.23 . . . . 0.0 113.584 -175.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.23 148.6 32.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 C-N-CA 124.522 1.129 . . . . 0.0 108.891 175.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -94.43 76.73 3.88 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 102.455 -3.165 . . . . 0.0 102.455 175.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.6 ttpt -60.26 -27.22 67.06 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 118.047 -0.978 . . . . 0.0 112.812 -175.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -69.35 -57.96 4.62 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 119.588 1.085 . . . . 0.0 109.927 176.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.96 -40.58 83.18 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.758 0.708 . . . . 0.0 110.982 -178.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.6 m -67.68 -29.84 69.21 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 121.369 -0.832 . . . . 0.0 111.4 -178.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.7 ttt85 -60.65 -33.18 72.43 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-O 117.418 -1.277 . . . . 0.0 109.508 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.63 -51.48 69.23 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 120.126 1.33 . . . . 0.0 110.118 -179.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.71 76.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 121.913 -0.492 . . . . 0.0 110.835 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -56.27 -38.92 71.82 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.051 0.54 . . . . 0.0 111.196 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -62.93 -55.88 22.04 Favored 'General case' 0 CA--C 1.522 -0.126 0 C-N-CA 124.854 1.262 . . . . 0.0 110.046 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mp -59.84 -32.17 70.43 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 81.6 t -75.62 -34.55 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-N 118.487 0.585 . . . . 0.0 109.528 176.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -72.33 -42.72 65.07 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 119.271 0.942 . . . . 0.0 111.239 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.64 136.64 57.19 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 126.408 1.883 . . . . 0.0 114.022 -175.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.408 ' CG ' HH22 ' A' ' 66' ' ' ARG . 0.8 OUTLIER -86.27 -21.91 27.1 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.539 1.536 . . . . 0.0 113.049 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.24 -33.07 36.86 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 108.789 -1.725 . . . . 0.0 108.789 175.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 t -66.4 123.72 20.77 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 175.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -78.04 -6.76 55.58 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.144 0.578 . . . . 0.0 111.442 175.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.6 t -70.17 127.42 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 175.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.04 -23.82 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 CA-C-O 118.376 -0.821 . . . . 0.0 109.716 175.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 38.6 p-90 -130.71 140.46 50.35 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.737 1.153 . . . . 0.0 110.701 178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 35.0 t -139.59 152.3 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 175.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 37.2 p -103.56 158.8 16.11 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -127.91 123.97 36.24 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -110.63 176.33 5.08 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -176.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -119.54 140.66 50.17 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 177.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -141.01 136.02 31.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 55.59 -96.35 0.04 OUTLIER Glycine 0 CA--C 1.531 1.045 0 CA-C-N 119.001 0.819 . . . . 0.0 111.654 -178.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.2 p -136.26 28.74 3.08 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.31 1.844 . . . . 0.0 111.333 175.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.8 t -143.92 163.66 32.81 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 -175.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.2 mm -83.67 138.94 18.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.0 m -134.26 159.43 72.33 Favored Pre-proline 0 C--N 1.329 -0.309 0 C-N-CA 124.765 1.226 . . . . 0.0 109.534 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.42 162.08 36.57 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 CA-C-N 120.801 1.322 . . . . 0.0 108.887 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -127.61 -165.0 11.78 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 126.263 1.887 . . . . 0.0 109.832 175.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -56.06 159.27 3.43 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.723 1.209 . . . . 0.0 110.914 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -145.2 168.21 20.94 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.184 1.394 . . . . 0.0 111.843 -175.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.1 -174.62 43.69 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 122.23 0.906 . . . . 0.0 112.328 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.41 -21.06 7.61 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.998 1.719 . . . . 0.0 110.992 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -106.24 117.36 33.83 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.571 1.148 . . . . 0.0 108.695 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -82.79 -16.09 49.17 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.24 0.616 . . . . 0.0 110.151 -177.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -62.57 -27.28 69.07 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 119.545 -1.972 . . . . 0.0 109.964 175.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -76.07 -31.4 58.75 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.74 1.216 . . . . 0.0 111.05 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -57.51 -35.97 70.94 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 125.009 1.323 . . . . 0.0 110.383 178.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.7 mm -58.58 -33.68 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 -176.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -77.78 -24.02 49.0 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.485 1.114 . . . . 0.0 112.213 177.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -72.3 -24.09 61.27 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 119.804 1.184 . . . . 0.0 112.091 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.5 m -65.97 132.97 49.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.772 0.715 . . . . 0.0 109.763 -177.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.856 ' HG1' ' CG2' ' A' ' 59' ' ' VAL 0.256 2.1 p -112.95 163.5 14.59 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.696 1.998 . . . . 0.0 110.622 -176.833 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -50.05 -76.38 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 130.224 3.41 . . . . 0.0 117.314 -175.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -102.67 -36.09 8.45 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 123.669 0.788 . . . . 0.0 112.667 -175.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.856 ' CG2' ' HG1' ' A' ' 56' ' ' THR . 17.4 m -56.73 147.98 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 CA-C-O 122.264 1.03 . . . . 0.0 112.078 -175.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.58 136.42 43.34 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 41.4 tp -138.19 167.81 21.05 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.918 1.287 . . . . 0.0 108.088 -176.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -132.39 146.97 52.35 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.427 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -144.45 124.49 13.59 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 118.39 0.541 . . . . 0.0 109.87 175.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -90.31 123.67 34.27 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 175.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.3 t -133.96 140.86 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 121.397 0.617 . . . . 0.0 109.764 -175.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.408 HH22 ' CG ' ' A' ' 23' ' ' ASP . 48.7 ttt180 -84.73 139.0 32.3 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.37 1.468 . . . . 0.0 108.667 175.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -136.2 150.24 48.91 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.159 1.384 . . . . 0.0 108.508 -176.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 99.3 m -96.95 113.46 25.0 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.0 m -156.76 153.66 28.73 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 121.004 -1.06 . . . . 0.0 110.289 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 117.18 167.73 14.5 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 126.461 1.981 . . . . 0.0 111.808 175.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -134.77 116.88 15.36 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.634 0.774 . . . . 0.0 111.097 -175.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.404 ' CB ' ' HE ' ' A' ' 76' ' ' ARG . . . -146.82 176.72 9.67 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 127.293 2.237 . . . . 0.0 105.788 174.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 25.5 mmt -70.6 6.68 1.33 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.608 0.763 . . . . 0.0 111.137 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.3 m -146.43 173.7 12.05 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.337 2.255 . . . . 0.0 108.84 175.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -63.3 163.59 10.28 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.852 0.834 . . . . 0.0 109.662 175.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.404 ' HE ' ' CB ' ' A' ' 72' ' ' ALA . 8.4 mmt85 -128.29 167.72 16.52 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 126.25 1.82 . . . . 0.0 108.096 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.3 t -133.24 142.48 48.56 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.0 mmtp -141.5 172.15 13.08 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 125.939 1.696 . . . . 0.0 108.002 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -145.55 130.03 17.85 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -177.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.83 119.02 33.61 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.69 113.24 21.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 103.295 -2.854 . . . . 0.0 103.295 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -85.28 132.89 30.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 176.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -116.46 123.28 47.11 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 101.873 -3.38 . . . . 0.0 101.873 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.1 t-105 -102.29 126.87 49.41 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 106.325 -1.732 . . . . 0.0 106.325 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.5 mt -138.48 102.0 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 N-CA-C 104.471 -2.418 . . . . 0.0 104.471 175.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.91 125.13 37.87 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 105.992 -2.843 . . . . 0.0 105.992 175.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -55.68 -3.88 0.09 Allowed 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 119.95 1.875 . . . . 0.0 115.003 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 -82.97 -31.35 27.64 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 120.596 -1.315 . . . . 0.0 109.723 177.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.9 p -69.58 136.66 25.75 Favored 'Isoleucine or valine' 0 C--N 1.343 0.31 0 CA-C-N 120.306 1.412 . . . . 0.0 109.588 176.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.3 t -144.04 177.01 8.87 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.306 1.442 . . . . 0.0 108.702 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.02 -145.3 49.63 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 176.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.68 -42.32 78.84 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 124.557 1.143 . . . . 0.0 110.901 -176.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -59.83 -43.42 94.57 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 119.215 0.916 . . . . 0.0 110.06 -176.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -69.64 -44.21 71.07 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.425 -0.797 . . . . 0.0 109.069 175.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.58 -23.47 50.95 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.144 0.978 . . . . 0.0 112.548 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -51.24 -53.82 31.68 Favored 'General case' 0 CA--C 1.504 -0.808 0 CA-C-N 119.772 1.169 . . . . 0.0 108.356 175.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.3 m -57.05 -41.04 77.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.737 0.699 . . . . 0.0 111.558 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.78 -18.78 64.51 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-N 118.161 0.437 . . . . 0.0 112.843 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.6 m -103.41 -17.74 15.12 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.416 1.086 . . . . 0.0 111.677 176.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -103.05 -23.99 13.65 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 117.755 2.502 . . . . 0.0 117.755 -174.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.2 mtmt -50.12 -28.01 6.61 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 122.212 2.278 . . . . 0.0 114.089 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.5 t -62.92 -35.5 80.3 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.119 1.327 . . . . 0.0 111.657 176.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 22.6 mt -61.73 -64.54 0.91 Allowed 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 126.554 1.942 . . . . 0.0 109.054 -176.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.92 -32.73 40.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.343 175.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -26.34 64.89 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 120.748 1.613 . . . . 0.0 111.793 175.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -64.38 -28.19 69.53 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 120.719 -1.238 . . . . 0.0 110.165 175.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 95.5 t -86.6 -65.59 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 125.338 1.455 . . . . 0.0 108.294 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 19.9 t -67.58 27.4 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.882 1 C-N-CA 132.97 4.508 . . . . 0.0 113.464 -175.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -52.63 -26.15 12.81 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.184 -1.573 . . . . 0.0 114.309 -175.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -104.83 95.22 5.73 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -150.66 163.33 38.78 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.298 1.039 . . . . 0.0 108.95 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.81 -66.69 0.58 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.83 163.46 5.01 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 131.493 3.917 . . . . 0.0 105.836 175.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -85.6 173.16 10.36 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 122.521 0.328 . . . . 0.0 111.018 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -129.59 157.45 42.05 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.5 t -116.95 123.81 72.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 175.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mt -132.06 126.71 56.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . 0.382 2.8 p -126.6 1.22 6.85 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 115.848 1.796 . . . . 0.0 115.848 175.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -146.17 158.03 43.86 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.802 0.841 . . . . 0.0 110.358 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -55.49 -42.25 74.14 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.836 175.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.42 -27.56 67.58 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 120.561 1.528 . . . . 0.0 112.612 178.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -83.37 -23.97 32.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.518 1.127 . . . . 0.0 110.751 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -75.56 -23.79 56.59 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.014 2.126 . . . . 0.0 113.091 -178.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -68.8 123.18 20.24 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -175.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -50.69 -32.12 18.41 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 115.973 1.842 . . . . 0.0 115.973 175.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -56.3 -32.31 64.48 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -108.03 -21.54 12.77 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.45 1.023 . . . . 0.0 108.589 175.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 46.8 mt -56.15 -36.97 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -58.73 -53.67 55.71 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.771 -0.581 . . . . 0.0 110.345 176.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 9.1 t -64.65 -31.79 73.17 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.135 0.879 . . . . 0.0 111.89 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -65.29 -52.89 51.19 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 124.997 1.319 . . . . 0.0 109.146 176.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 47.3 mt -60.88 -34.72 75.05 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.499 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -62.13 -52.98 61.67 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.194 0.906 . . . . 0.0 108.846 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 26.5 mmtt -54.28 -52.58 60.99 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.413 0.685 . . . . 0.0 110.928 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.48 -26.24 66.27 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.49 122.62 10.92 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 124.163 0.887 . . . . 0.0 112.264 -175.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -139.22 169.01 24.67 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 125.341 1.448 . . . . 0.0 109.571 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.87 122.16 10.21 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 125.028 1.331 . . . . 0.0 111.372 -176.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -153.34 110.14 3.42 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 105.424 -2.065 . . . . 0.0 105.424 175.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -136.52 71.49 1.42 Allowed 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 122.702 1.239 . . . . 0.0 107.669 176.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -69.58 114.71 8.05 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 113.553 -1.658 . . . . 0.0 108.388 -176.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -73.99 112.91 10.57 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -133.08 143.03 49.06 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.382 1.073 . . . . 0.0 108.442 -175.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 62.53 50.0 3.77 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.732 1.213 . . . . 0.0 110.73 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 125.448 1.499 . . . . 0.0 107.569 175.6 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.805 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -142.14 173.28 7.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 127.218 2.207 . . . . 0.0 107.757 176.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -63.73 127.99 33.81 Favored 'General case' 0 CA--C 1.521 -0.146 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.97 175.9 9.25 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.685 0.794 . . . . 0.0 111.214 178.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -133.8 56.35 1.85 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.032 1.333 . . . . 0.0 110.706 -179.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.4 m -110.38 170.74 7.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.335 1.854 . . . . 0.0 106.07 175.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -125.09 172.71 9.25 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.778 -1.201 . . . . 0.0 110.819 -176.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.68 153.4 17.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 C-N-CA 124.582 1.153 . . . . 0.0 109.29 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -94.6 73.37 3.71 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 102.69 -3.078 . . . . 0.0 102.69 175.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 31.4 pttt -58.88 -27.84 65.57 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 117.454 -1.26 . . . . 0.0 111.448 -175.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.2 -56.39 5.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.191 0.997 . . . . 0.0 110.068 -175.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.78 -35.45 77.07 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 121.2 -0.2 . . . . 0.0 110.684 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.0 m -69.46 -34.21 74.05 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 118.534 -0.746 . . . . 0.0 110.363 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 76.0 ttt-85 -60.09 -39.63 86.82 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.846 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.62 -59.0 5.31 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 123.878 0.737 . . . . 0.0 109.489 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.14 -36.7 84.89 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.873 -0.517 . . . . 0.0 112.121 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -62.2 -28.77 69.91 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.181 0.992 . . . . 0.0 111.207 175.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -74.89 -46.37 36.49 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 124.264 1.025 . . . . 0.0 109.376 175.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.5 mp -57.13 -56.39 22.35 Favored 'General case' 0 C--O 1.221 -0.396 0 O-C-N 121.586 -0.696 . . . . 0.0 110.627 175.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.9 t -59.45 -29.08 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 118.494 0.588 . . . . 0.0 111.13 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -69.94 -45.43 67.49 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 119.992 1.269 . . . . 0.0 111.224 175.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -63.36 123.65 19.25 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.994 1.718 . . . . 0.0 111.311 -175.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -64.81 -27.85 69.16 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.975 1.31 . . . . 0.0 111.992 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.15 -11.31 76.27 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 124.4 1.0 . . . . 0.0 112.669 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -62.08 128.75 37.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 119.046 1.423 . . . . 0.0 108.461 176.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.26 -35.78 82.1 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.8 t -72.5 126.26 32.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 125.42 1.488 . . . . 0.0 108.23 175.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.3 pp -113.72 -23.68 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 124.967 1.307 . . . . 0.0 111.062 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -128.08 145.63 50.94 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.784 0.72 . . . . 0.0 109.975 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.5 t -135.83 161.82 37.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 126.482 1.913 . . . . 0.0 107.636 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.441 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 14.2 p -119.54 159.26 24.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.377 1.071 . . . . 0.0 108.939 175.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -137.09 127.8 27.11 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.378 1.471 . . . . 0.0 107.254 -177.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -113.74 176.75 4.9 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 127.074 2.15 . . . . 0.0 107.805 -178.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -118.91 138.22 52.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 175.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -137.48 132.43 33.3 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 59.12 -107.43 1.2 Allowed Glycine 0 CA--C 1.529 0.945 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -175.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.1 p -130.09 29.84 4.87 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.899 1.279 . . . . 0.0 111.704 175.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -130.37 169.1 15.91 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.635 0.652 . . . . 0.0 110.215 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 38.5 mm -94.98 138.33 21.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 104.21 -2.515 . . . . 0.0 104.21 175.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.3 m -130.81 154.32 81.86 Favored Pre-proline 0 C--N 1.329 -0.309 0 C-N-CA 124.067 0.947 . . . . 0.0 110.326 176.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -75.81 159.66 38.21 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 C-N-CA 121.986 1.791 . . . . 0.0 109.386 175.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -130.62 -162.77 10.8 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 127.201 2.334 . . . . 0.0 108.965 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -58.93 166.92 1.78 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 126.2 1.8 . . . . 0.0 111.723 -176.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.74 171.31 16.44 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 124.749 1.219 . . . . 0.0 111.127 -175.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -171.97 -178.06 41.98 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 123.763 0.697 . . . . 0.0 111.891 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.3 -26.69 7.08 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.871 1.268 . . . . 0.0 111.378 176.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -105.81 130.26 53.82 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 105.672 -1.973 . . . . 0.0 105.672 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.419 ' CE2' ' CD2' ' A' ' 51' ' ' PHE . 21.6 t80 -82.84 -9.47 59.31 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.511 0.724 . . . . 0.0 110.413 -175.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -54.22 -33.73 59.0 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.329 -1.482 . . . . 0.0 110.607 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.4 m80 -68.27 -25.04 64.97 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.305 1.442 . . . . 0.0 112.772 176.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.419 ' CD2' ' CE2' ' A' ' 48' ' ' TYR . 0.6 OUTLIER -62.84 -52.41 63.24 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.158 -0.964 . . . . 0.0 108.842 178.393 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.41 -40.31 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -178.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -61.23 -32.81 72.59 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.172 0.989 . . . . 0.0 112.362 175.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -81.27 -23.59 37.86 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 117.857 -1.068 . . . . 0.0 113.563 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 92.4 m -53.62 114.35 1.5 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 120.183 1.356 . . . . 0.0 111.756 -175.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.427 ' HG1' ' CG2' ' A' ' 59' ' ' VAL 0.25 2.0 p -83.91 164.8 19.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.91 2.084 . . . . 0.0 112.153 -178.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.46 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 6.8 p-10 -55.34 -77.12 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 131.153 3.781 . . . . 0.0 120.645 -175.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.46 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 12.6 t70 -106.56 -20.79 13.26 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 127.042 2.137 . . . . 0.0 114.673 -174.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.427 ' CG2' ' HG1' ' A' ' 56' ' ' THR . 3.0 m -68.11 168.67 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-O 122.484 1.135 . . . . 0.0 113.388 -175.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.75 123.37 42.51 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 103.109 -2.923 . . . . 0.0 103.109 175.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 42.7 tp -130.65 168.12 17.66 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.864 2.066 . . . . 0.0 109.072 -175.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -132.5 155.45 48.55 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 123.547 0.739 . . . . 0.0 109.679 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.441 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -146.23 137.25 24.41 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.272 0.629 . . . . 0.0 110.86 176.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -104.91 123.83 48.42 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 105.864 -1.902 . . . . 0.0 105.864 175.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.7 t -133.11 136.52 55.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 -175.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.3 ttp-105 -80.83 134.44 35.78 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -136.1 159.75 40.75 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.835 0.854 . . . . 0.0 108.97 -175.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.7 m -111.04 113.42 25.95 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 120.612 -1.305 . . . . 0.0 109.137 -177.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 14.6 m -155.99 163.6 39.51 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 175.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 91.79 157.21 33.46 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 108.248 -1.941 . . . . 0.0 108.248 -175.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -138.5 133.42 32.65 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.171 0.588 . . . . 0.0 109.754 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -145.98 -174.01 4.31 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 127.64 2.376 . . . . 0.0 108.113 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 63.1 mtm -76.46 -6.35 51.38 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.266 -0.896 . . . . 0.0 111.228 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.0 m -126.06 164.23 21.31 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 127.224 2.21 . . . . 0.0 107.49 175.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -62.99 157.47 21.81 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -122.15 162.66 20.9 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 -176.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.2 t -138.87 142.13 38.6 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 106.255 -1.757 . . . . 0.0 106.255 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -143.8 173.97 11.22 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 127.271 2.228 . . . . 0.0 106.525 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -146.35 139.04 25.37 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.83 121.39 43.85 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 175.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.96 113.35 25.59 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 101.52 -3.511 . . . . 0.0 101.52 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mp -94.31 144.37 9.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 -178.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -124.05 123.45 40.38 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 103.186 -2.894 . . . . 0.0 103.186 175.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -100.11 128.63 46.16 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 105.129 -2.174 . . . . 0.0 105.129 175.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.0 mt -131.84 103.64 7.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 102.723 -3.065 . . . . 0.0 102.723 175.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.432 ' C ' ' H ' ' A' ' 88' ' ' ASN . . . -55.42 122.84 28.03 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 106.8 -2.52 . . . . 0.0 106.8 175.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -55.0 -3.61 0.05 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.561 1.544 . . . . 0.0 114.154 -175.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 86' ' ' GLY . 53.4 m-80 -83.53 -23.84 31.89 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.692 1.597 . . . . 0.0 110.343 179.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.9 p -85.87 144.98 8.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-N 120.714 1.597 . . . . 0.0 108.884 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.6 t -146.3 176.56 9.67 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 126.21 1.804 . . . . 0.0 107.41 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 61.04 -146.9 47.55 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 123.312 0.482 . . . . 0.0 113.54 176.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.3 tt -47.11 -51.39 18.0 Favored 'General case' 0 C--N 1.335 -0.029 0 C-N-CA 126.079 1.752 . . . . 0.0 113.504 -175.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.45 -38.36 86.91 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 120.277 1.399 . . . . 0.0 111.174 -178.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.2 ttt180 -65.78 -47.65 74.46 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 175.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.83 -27.02 66.27 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.613 1.165 . . . . 0.0 112.991 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -50.82 -42.53 58.4 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 120.34 1.427 . . . . 0.0 110.281 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.7 m -54.62 -35.6 63.59 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 124.783 1.233 . . . . 0.0 110.256 -177.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.93 -26.33 74.48 Favored Glycine 0 CA--C 1.526 0.77 0 O-C-N 121.499 -0.75 . . . . 0.0 112.817 179.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.8 m -95.39 -8.69 34.9 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.545 1.538 . . . . 0.0 111.016 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -104.22 -29.66 10.68 Favored 'General case' 0 CA--C 1.514 -0.417 0 O-C-N 121.044 -1.035 . . . . 0.0 111.771 -175.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.1 mtpt -52.82 -35.24 56.79 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 118.932 0.787 . . . . 0.0 110.686 176.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.8 t -62.91 -37.64 87.77 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.73 0.695 . . . . 0.0 111.947 176.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.0 mt -63.43 -60.02 3.92 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 124.388 1.075 . . . . 0.0 109.665 -176.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.85 -30.96 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 117.726 -1.131 . . . . 0.0 109.886 176.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.66 -46.47 88.93 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 120.337 1.426 . . . . 0.0 109.887 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -56.32 -25.07 47.59 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 77.8 t -85.29 -62.51 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 21.2 t -68.77 27.25 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.887 1 C-N-CA 131.864 4.065 . . . . 0.0 113.706 -175.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -54.12 -26.55 28.03 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 119.789 -1.819 . . . . 0.0 115.098 -175.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -94.87 81.38 3.76 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 175.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -142.04 170.79 15.05 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 125.406 1.482 . . . . 0.0 108.752 176.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -87.55 -66.58 0.9 Allowed 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.71 176.24 12.62 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 128.856 2.863 . . . . 0.0 106.26 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.46 169.39 9.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.827 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -141.04 149.57 41.85 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 103.927 -2.62 . . . . 0.0 103.927 -175.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 48.4 t -121.94 128.67 75.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.7 mt -133.38 148.78 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 125.632 1.573 . . . . 0.0 107.976 -176.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 79.4 p -145.19 1.69 0.97 Allowed 'General case' 0 C--O 1.235 0.29 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -127.2 136.45 52.05 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 125.612 1.565 . . . . 0.0 107.387 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.43 -50.49 40.51 Favored 'General case' 0 CA--C 1.517 -0.302 0 C-N-CA 123.945 0.898 . . . . 0.0 110.683 177.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -33.92 76.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 118.01 0.368 . . . . 0.0 110.504 -175.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -67.51 -23.32 65.45 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.937 1.295 . . . . 0.0 110.781 175.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -85.1 -23.91 28.28 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 125.315 1.446 . . . . 0.0 112.728 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -58.45 123.81 17.46 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.21 0.914 . . . . 0.0 109.671 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.451 ' HB3' ' HE3' ' A' ' 129' ' ' LYS . 27.5 mt-10 -65.35 -19.54 66.0 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 121.35 -0.844 . . . . 0.0 113.274 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -51.98 -51.43 57.31 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.139 0.881 . . . . 0.0 112.779 -175.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -85.62 -24.31 27.18 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.045 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 41.9 mt -56.92 -38.59 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 119.783 1.174 . . . . 0.0 108.376 175.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.451 ' HE3' ' HB3' ' A' ' 125' ' ' GLU . 41.4 mttt -52.94 -50.64 63.63 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.196 0.598 . . . . 0.0 109.783 176.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.5 t -66.0 -35.31 80.21 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.184 1.394 . . . . 0.0 112.064 176.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -63.7 -47.88 79.37 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.285 0.948 . . . . 0.0 109.201 176.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.77 -34.34 77.03 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.976 0.91 . . . . 0.0 109.88 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -65.57 -42.89 91.28 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.103 0.865 . . . . 0.0 109.274 175.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? -61.72 -52.83 62.64 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.641 0.776 . . . . 0.0 109.756 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -76.03 20.23 0.2 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.202 1.001 . . . . 0.0 112.499 176.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -71.39 178.85 34.03 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 124.228 0.918 . . . . 0.0 111.443 -176.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 93.33 119.93 2.92 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -176.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -163.68 169.03 19.07 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 126.828 2.051 . . . . 0.0 107.981 175.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -153.54 105.5 2.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 175.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -143.22 104.61 4.3 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 102.841 -3.022 . . . . 0.0 102.841 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.3 t0 -63.68 143.94 57.43 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 123.751 0.82 . . . . 0.0 110.647 -175.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -85.44 100.93 12.2 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 103.611 -2.737 . . . . 0.0 103.611 175.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -104.95 159.59 15.69 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 -176.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 64.06 38.64 8.36 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.855 1.262 . . . . 0.0 109.688 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 117.713 -1.137 . . . . 0.0 110.436 175.939 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.835 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.6 mp -114.58 -83.45 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.5 ptt-85 -143.8 164.12 31.4 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.594 1.558 . . . . 0.0 108.507 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 7.5 tpt -156.09 165.06 37.55 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.228 0.922 . . . . 0.0 108.786 175.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -76.01 59.1 1.26 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.831 1.252 . . . . 0.0 111.406 176.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.2 m -134.72 168.78 18.39 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 127.239 2.215 . . . . 0.0 105.797 176.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 45.4 tttm -138.51 172.54 12.73 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 120.642 -1.286 . . . . 0.0 108.836 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -122.84 149.52 26.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -83.23 85.03 7.28 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 103.432 -2.803 . . . . 0.0 103.432 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -62.54 -23.72 67.13 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.484 -1.246 . . . . 0.0 113.119 -175.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -79.13 -57.5 3.7 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 119.874 1.215 . . . . 0.0 108.112 179.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.17 -35.61 81.36 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.714 -176.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 82.9 m -80.04 -32.77 39.47 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 119.054 0.843 . . . . 0.0 111.037 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.7 ttt-85 -66.78 -26.86 67.17 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 117.328 -1.32 . . . . 0.0 109.713 175.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.89 -62.46 1.65 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 120.44 1.473 . . . . 0.0 109.441 176.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.79 -47.59 73.8 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.289 0.636 . . . . 0.0 111.431 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -52.15 -46.92 65.61 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 122.44 0.296 . . . . 0.0 110.965 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -64.41 -40.74 96.36 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.1 -0.953 . . . . 0.0 111.35 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.7 mp -60.4 -61.38 2.64 Favored 'General case' 0 C--O 1.221 -0.419 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 175.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.1 t -58.15 -32.96 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 122.806 0.442 . . . . 0.0 111.914 -175.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.85 -26.35 63.23 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 119.234 0.925 . . . . 0.0 110.9 176.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -76.02 127.41 32.9 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 118.986 0.812 . . . . 0.0 110.201 -177.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -61.37 -28.18 69.05 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.808 -0.557 . . . . 0.0 111.113 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.78 1.37 78.82 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.578 1.085 . . . . 0.0 113.627 178.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.8 t -85.98 124.9 32.95 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 120.627 2.213 . . . . 0.0 107.856 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.4 -33.12 71.01 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.9 t -64.73 131.01 30.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 C-N-CA 125.067 1.347 . . . . 0.0 107.389 175.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.3 pp -114.19 -23.62 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.448 1.499 . . . . 0.0 111.037 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.1 p-90 -131.74 146.89 52.41 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 118.814 0.733 . . . . 0.0 111.201 178.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 39.9 t -141.46 150.25 19.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 175.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.403 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 38.8 p -103.62 161.74 13.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -130.79 137.96 49.69 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 105.886 -1.894 . . . . 0.0 105.886 175.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -125.61 177.04 6.46 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 126.664 1.985 . . . . 0.0 107.396 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -118.52 137.28 53.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -133.96 123.83 25.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 175.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 58.3 -80.81 0.01 OUTLIER Glycine 0 CA--C 1.529 0.925 0 C-N-CA 126.005 1.764 . . . . 0.0 113.896 176.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.53 10.03 3.71 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.747 2.419 . . . . 0.0 113.664 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -149.82 173.24 13.97 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 120.266 1.394 . . . . 0.0 113.047 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 18.6 mm -84.28 140.03 16.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 175.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.4 m -131.17 160.52 66.63 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 125.482 1.513 . . . . 0.0 110.781 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.55 156.53 36.21 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.497 2.131 . . . . 0.0 109.94 175.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -126.46 -166.83 12.3 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 126.141 1.829 . . . . 0.0 109.532 175.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -54.05 161.67 1.18 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 117.948 0.874 . . . . 0.0 112.891 175.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.8 pm0 -141.79 164.71 29.46 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 127.582 2.353 . . . . 0.0 110.653 -175.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -167.03 172.73 42.2 Favored Glycine 0 CA--C 1.525 0.675 0 CA-C-O 121.837 0.687 . . . . 0.0 111.652 176.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -111.93 -2.7 15.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.647 1.179 . . . . 0.0 112.663 -176.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -139.47 150.41 45.14 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -83.6 -9.85 58.64 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.755 0.707 . . . . 0.0 111.875 -175.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -58.49 -39.57 80.38 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 120.597 -1.314 . . . . 0.0 110.252 175.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -76.21 -14.41 60.15 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.986 1.315 . . . . 0.0 112.781 176.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -72.84 -36.8 67.54 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 123.552 0.741 . . . . 0.0 110.147 175.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.7 mm -55.76 -44.97 79.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.31 0.644 . . . . 0.0 109.841 -175.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -61.72 -23.56 66.22 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.358 1.063 . . . . 0.0 113.495 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -70.99 -30.92 67.31 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.628 1.104 . . . . 0.0 112.1 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 56.7 m -72.25 113.58 9.44 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 105.513 -2.032 . . . . 0.0 105.513 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.265 2.5 p -115.31 166.82 11.44 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.646 1.178 . . . . 0.0 113.273 -175.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.434 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 3.5 p-10 -40.47 -69.45 0.13 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 131.008 3.723 . . . . 0.0 119.286 -174.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.434 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 4.8 t70 -106.05 -36.21 7.01 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.535 1.934 . . . . 0.0 115.974 -174.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 33.7 m -69.06 167.44 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-O 123.244 1.497 . . . . 0.0 114.615 -175.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.66 145.37 38.07 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 103.206 -2.887 . . . . 0.0 103.206 174.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.2 tp -144.33 165.05 29.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 119.869 1.213 . . . . 0.0 107.751 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -130.89 152.58 50.07 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 176.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.403 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -152.97 135.51 15.18 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 119.037 0.835 . . . . 0.0 112.412 175.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -95.83 123.18 39.3 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 104.906 -2.257 . . . . 0.0 104.906 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 50.3 t -133.87 137.94 51.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -176.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -78.13 138.62 38.81 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -135.99 161.63 35.12 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.842 1.657 . . . . 0.0 107.489 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.3 m -126.64 113.42 16.7 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 120.755 -1.216 . . . . 0.0 108.473 -177.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 4.2 m -156.12 169.85 23.54 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 127.553 2.341 . . . . 0.0 105.981 175.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 100.42 144.47 15.86 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 103.98 -3.648 . . . . 0.0 103.98 -175.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -124.43 122.18 36.95 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 -175.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.53 176.1 10.07 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 126.167 1.787 . . . . 0.0 108.345 175.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 95.7 mtp -71.68 4.08 3.5 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.277 1.031 . . . . 0.0 111.829 175.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.5 m -146.4 175.67 10.37 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 119.856 -1.777 . . . . 0.0 108.823 -176.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.69 154.09 30.46 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.983 0.897 . . . . 0.0 108.984 -178.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -127.73 163.33 24.55 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.519 1.528 . . . . 0.0 108.297 -178.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.6 t -146.35 142.64 28.44 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -138.71 170.2 16.43 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.919 1.688 . . . . 0.0 106.966 176.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -146.38 129.77 16.77 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.8 133.93 49.74 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -99.88 113.21 25.6 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 102.296 -3.224 . . . . 0.0 102.296 175.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.2 mp -91.4 141.31 14.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -123.59 123.21 40.08 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 101.762 -3.422 . . . . 0.0 101.762 175.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.7 t-105 -95.44 123.41 38.96 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 103.84 -2.652 . . . . 0.0 103.84 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.8 mt -142.41 85.7 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 102.384 -3.191 . . . . 0.0 102.384 175.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.69 144.48 7.19 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 176.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.9 tm-20 -57.28 -18.56 17.11 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -83.85 -36.23 23.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 124.778 1.231 . . . . 0.0 112.426 -177.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -73.87 123.32 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 107.216 -1.401 . . . . 0.0 107.216 175.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 5.1 t -146.22 176.38 9.79 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.717 1.207 . . . . 0.0 108.942 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 84.47 -148.7 24.13 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.743 -0.598 . . . . 0.0 111.719 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -54.75 -29.9 55.05 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.46 1.104 . . . . 0.0 109.309 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -57.64 -43.57 84.98 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.058 -1.026 . . . . 0.0 110.82 175.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -43.54 74.8 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 175.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.05 -31.07 64.8 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.237 0.615 . . . . 0.0 112.115 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -59.4 -61.42 2.64 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 175.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 96.4 m -53.75 -40.01 65.8 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 122.656 0.383 . . . . 0.0 110.676 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.68 -22.25 61.62 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 123.592 0.615 . . . . 0.0 114.296 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 63.7 m -108.49 -8.1 15.62 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.104 1.361 . . . . 0.0 111.902 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -103.27 -24.74 13.51 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.767 1.227 . . . . 0.0 112.189 -175.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.513 ' HZ2' ' HG3' ' A' ' 114' ' ' GLU . 54.7 mtpt -55.62 -33.27 63.84 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 120.294 1.406 . . . . 0.0 111.383 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.2 t -59.36 -36.84 76.48 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.95 0.795 . . . . 0.0 112.075 175.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 12.7 mt -63.19 -63.84 1.08 Allowed 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 125.14 1.376 . . . . 0.0 109.319 -175.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -32.88 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-O 117.73 -1.128 . . . . 0.0 109.793 175.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.81 -37.41 86.62 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.75 1.614 . . . . 0.0 110.418 176.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.33 -24.77 65.3 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.308 0.958 . . . . 0.0 111.374 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 58.9 t -84.98 -54.02 9.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 175.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 72.1 t -71.85 14.01 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 130.269 3.428 . . . . 0.0 113.35 -175.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -50.25 -26.55 4.84 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 119.759 -1.838 . . . . 0.0 115.119 -175.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -92.32 52.08 1.88 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.241 1.017 . . . . 0.0 109.646 175.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.08 176.46 5.12 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.72 2.008 . . . . 0.0 110.705 177.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.8 -67.07 0.86 Allowed 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -165.09 176.17 8.76 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 128.495 2.718 . . . . 0.0 108.734 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.513 ' HG3' ' HZ2' ' A' ' 101' ' ' LYS . 0.6 OUTLIER -113.61 173.61 6.33 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 124.663 1.185 . . . . 0.0 111.685 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -147.54 155.99 42.4 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 105.156 -2.164 . . . . 0.0 105.156 -175.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 14.3 t -129.08 124.9 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 175.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mt -125.19 141.29 45.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 125.804 1.641 . . . . 0.0 107.867 -175.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 10.2 p -131.07 -9.81 3.81 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -175.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -145.97 160.64 41.57 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 118.447 0.567 . . . . 0.0 110.771 -175.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -53.38 -42.86 67.35 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.254 1.421 . . . . 0.0 111.204 176.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -67.47 -37.15 82.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.636 0.653 . . . . 0.0 111.989 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -71.77 -23.66 61.63 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.896 0.879 . . . . 0.0 110.545 177.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -80.77 -24.56 38.55 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.095 -1.003 . . . . 0.0 113.38 -176.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -61.5 123.61 18.34 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.904 0.774 . . . . 0.0 111.492 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -54.66 -23.61 18.1 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -56.42 -49.99 72.95 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 -175.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -88.94 -25.65 21.96 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.873 177.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 34.5 mt -52.7 -43.41 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -55.0 -50.48 68.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 119.083 -0.484 . . . . 0.0 111.048 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.5 t -64.08 -43.32 95.77 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-O 118.803 -0.618 . . . . 0.0 110.604 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -53.65 -52.81 58.75 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.543 1.137 . . . . 0.0 109.372 177.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.12 -29.29 70.13 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.008 0.923 . . . . 0.0 112.159 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -72.29 -44.27 63.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.393 1.077 . . . . 0.0 110.018 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 45.8 mmtt -60.53 -53.53 56.46 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 176.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.19 -9.88 12.98 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.186 1.394 . . . . 0.0 113.103 178.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -72.06 -18.68 77.98 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 119.322 0.964 . . . . 0.0 111.823 175.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -74.96 145.93 34.34 Favored Glycine 0 C--N 1.338 0.665 0 N-CA-C 109.193 -1.563 . . . . 0.0 109.193 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -73.49 146.82 44.62 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 118.309 1.054 . . . . 0.0 110.036 176.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -150.15 124.37 9.48 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 175.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -147.42 99.73 3.17 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 123.721 0.809 . . . . 0.0 109.371 -175.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -129.86 141.88 50.75 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.621 1.168 . . . . 0.0 108.783 175.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -144.09 120.78 11.17 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 126.133 1.773 . . . . 0.0 107.245 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -137.03 160.15 39.78 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 126.178 1.791 . . . . 0.0 108.593 177.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 41.81 44.94 2.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.573 2.349 . . . . 0.0 110.68 -175.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 117.715 -1.136 . . . . 0.0 109.513 -179.376 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.063 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 28.1 mm -137.63 -73.06 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-N 118.718 1.259 . . . . 0.0 109.292 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -77.82 72.85 4.39 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.286 0.948 . . . . 0.0 110.43 -175.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 45.0 mtm -147.2 176.48 9.94 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 128.326 2.65 . . . . 0.0 107.513 175.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.27 59.64 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 127.992 2.517 . . . . 0.0 114.137 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.3 m -64.05 157.33 25.54 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.51 2.324 . . . . 0.0 108.409 176.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -131.74 175.44 9.19 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.266 1.026 . . . . 0.0 110.119 -176.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -121.42 151.98 24.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 O-C-N 121.541 -0.725 . . . . 0.0 110.247 176.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -87.19 65.71 8.95 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 104.87 -2.271 . . . . 0.0 104.87 175.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.93 -39.93 63.22 Favored 'General case' 0 CA--C 1.512 -0.482 0 C-N-CA 124.395 1.078 . . . . 0.0 111.931 -175.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -67.84 -35.23 78.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 118.753 0.706 . . . . 0.0 111.771 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.29 -50.26 16.64 Favored 'General case' 0 CA--C 1.523 -0.084 0 CA-C-N 119.727 1.149 . . . . 0.0 109.882 175.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.0 m -62.36 -27.79 69.31 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.906 -0.496 . . . . 0.0 110.996 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -58.52 -41.61 85.84 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 117.72 -1.133 . . . . 0.0 109.518 175.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.54 -54.32 38.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 123.779 0.674 . . . . 0.0 110.116 -175.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.08 75.15 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -52.94 -40.66 63.82 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 119.015 -0.517 . . . . 0.0 109.618 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -58.43 -48.77 79.62 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 123.448 0.699 . . . . 0.0 111.013 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mp -54.33 -56.36 19.25 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 124.029 0.932 . . . . 0.0 110.856 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.0 -30.08 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 122.146 -0.346 . . . . 0.0 111.089 -176.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.0 ttp85 -76.89 -25.05 52.59 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.382 1.073 . . . . 0.0 112.273 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -83.67 124.35 30.75 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 126.185 1.794 . . . . 0.0 112.313 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -64.83 -22.27 66.95 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 123.924 0.89 . . . . 0.0 112.869 175.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.76 -14.35 75.77 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-N 119.169 0.895 . . . . 0.0 112.854 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.5 t -70.13 146.03 51.13 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.898 1.349 . . . . 0.0 111.942 -175.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.03 -29.58 23.34 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 175.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.8 t -74.86 129.95 36.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 176.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.87 -24.02 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 O-C-N 124.296 0.997 . . . . 0.0 110.235 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -125.45 144.65 50.43 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 124.349 1.06 . . . . 0.0 109.275 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.9 t -137.53 162.78 32.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 C-N-CA 128.501 2.72 . . . . 0.0 107.631 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.441 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 51.0 p -132.06 162.22 31.31 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.601 1.161 . . . . 0.0 108.174 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -133.92 143.82 48.46 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -120.64 176.67 5.4 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.537 ' HH ' ' HB3' ' A' ' 100' ' ' ASP . 23.9 m-85 -120.33 141.01 50.42 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.479 0.712 . . . . 0.0 109.118 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -151.09 123.83 8.56 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.066 0.946 . . . . 0.0 109.285 175.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 54.19 -125.9 34.91 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.1 p -98.34 30.05 3.34 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 124.516 1.127 . . . . 0.0 111.945 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.6 t -151.84 165.4 34.62 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 175.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 12.2 mm -89.41 135.03 27.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 103.743 -2.688 . . . . 0.0 103.743 175.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.34 167.19 14.66 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 124.687 1.195 . . . . 0.0 109.297 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -66.06 170.08 12.4 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 CA-C-N 120.506 1.216 . . . . 0.0 111.302 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -135.41 -168.11 11.5 Favored Glycine 0 CA--C 1.523 0.559 0 C-N-CA 125.614 1.578 . . . . 0.0 109.85 176.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -74.69 170.46 15.78 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 124.566 1.146 . . . . 0.0 109.731 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -146.46 168.47 21.12 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 124.949 1.3 . . . . 0.0 110.206 -176.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.33 -178.03 46.67 Favored Glycine 0 CA--C 1.521 0.41 0 CA-C-O 121.968 0.76 . . . . 0.0 112.772 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.76 -24.11 7.31 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.552 1.541 . . . . 0.0 110.776 176.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -109.12 123.21 48.83 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -83.1 -15.88 49.08 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.368 -175.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -54.11 -34.54 60.52 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 121.468 1.94 . . . . 0.0 111.666 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -66.16 -32.98 74.75 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 123.429 0.692 . . . . 0.0 112.123 175.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.95 -45.59 67.79 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.292 1.437 . . . . 0.0 109.622 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 mp -63.46 -33.12 59.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.507 -0.745 . . . . 0.0 110.958 -178.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -80.21 -26.45 39.15 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.961 1.304 . . . . 0.0 110.269 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -71.98 -39.02 69.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.451 1.5 . . . . 0.0 110.278 176.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 67.4 m -50.49 114.36 1.11 Allowed 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.953 1.301 . . . . 0.0 111.246 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 p -84.26 143.24 29.69 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 127.995 2.518 . . . . 0.0 110.635 -176.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -50.54 -59.74 3.72 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 126.172 1.789 . . . . 0.0 112.94 -177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -106.67 -33.79 7.51 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 125.496 1.518 . . . . 0.0 113.927 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.5 m -72.31 155.11 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 C-N-CA 118.086 -1.446 . . . . 0.0 109.429 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.7 151.44 22.99 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -178.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.3 tp -147.48 157.35 43.53 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 124.424 1.09 . . . . 0.0 108.478 -175.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -128.84 142.77 50.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.441 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -137.46 124.08 21.01 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 123.838 0.855 . . . . 0.0 112.001 -176.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -95.85 123.57 39.49 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 105.27 -2.122 . . . . 0.0 105.27 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.9 t -136.53 143.57 35.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 123.365 0.666 . . . . 0.0 109.395 -175.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.52 136.2 33.21 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -136.27 170.76 15.51 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.755 2.022 . . . . 0.0 107.81 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m -132.99 127.79 34.93 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.639 1.576 . . . . 0.0 110.116 176.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.9 m -156.42 152.42 27.48 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 175.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.77 131.58 1.36 Allowed Glycine 0 C--N 1.332 0.334 0 N-CA-C 103.896 -3.682 . . . . 0.0 103.896 -175.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -137.29 149.88 47.4 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -174.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.28 -173.03 4.07 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 131.314 3.846 . . . . 0.0 105.128 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 27.9 mmt -62.88 -6.37 3.71 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 120.318 1.417 . . . . 0.0 110.969 175.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.5 m -125.63 143.23 51.12 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 130.028 3.331 . . . . 0.0 105.979 175.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -67.79 154.57 41.23 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 87.9 mtt-85 -111.8 165.68 11.85 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.7 t -133.51 135.99 44.78 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.7 mtpp -139.87 123.97 17.75 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 125.933 1.693 . . . . 0.0 107.791 -175.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.57 134.76 33.62 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 176.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -108.01 127.9 54.18 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.542 1.537 . . . . 0.0 107.169 176.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -103.99 113.27 26.69 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 175.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.8 mp -93.74 135.46 28.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 -177.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -117.38 123.47 46.52 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 106.071 -1.825 . . . . 0.0 106.071 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 52.1 t-105 -100.96 123.41 45.11 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 105.745 -1.946 . . . . 0.0 105.745 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.7 mm -141.56 89.84 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 101.001 -3.703 . . . . 0.0 101.001 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.48 145.0 8.25 Favored Glycine 0 C--N 1.339 0.726 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.44 -5.44 7.72 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.103 0.951 . . . . 0.0 113.134 -175.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -83.3 -35.5 25.2 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 124.799 1.24 . . . . 0.0 111.771 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.2 p -82.71 132.78 30.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 120.074 1.307 . . . . 0.0 109.656 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.5 t -146.22 176.56 9.66 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 126.674 1.99 . . . . 0.0 108.589 -175.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 81.29 -155.48 36.2 Favored Glycine 0 CA--C 1.519 0.311 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.49 -29.56 59.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 122.963 0.505 . . . . 0.0 110.959 -177.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 -57.22 -39.41 75.42 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.872 1.669 . . . . 0.0 111.334 176.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -71.45 -53.05 15.28 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 175.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.65 -23.39 6.49 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 117.225 -1.369 . . . . 0.0 113.527 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -48.82 -44.11 38.98 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 120.678 1.581 . . . . 0.0 109.184 175.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.2 m -56.29 -27.78 56.57 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.983 1.713 . . . . 0.0 111.918 178.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -75.95 -25.92 65.75 Favored Glycine 0 CA--C 1.529 0.943 0 O-C-N 120.809 -1.182 . . . . 0.0 112.449 175.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 54.6 m -93.32 -20.18 20.64 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.806 1.242 . . . . 0.0 110.136 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.537 ' HB3' ' HH ' ' A' ' 34' ' ' TYR . 79.4 m-20 -104.14 -23.97 13.22 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -174.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -58.14 -33.04 68.75 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 122.353 2.342 . . . . 0.0 111.225 177.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.9 t -68.53 -27.49 66.15 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.663 1.12 . . . . 0.0 112.25 175.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 15.5 mt -67.85 -62.16 1.54 Allowed 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.301 0.8 OUTLIER -57.87 -24.69 23.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.313 175.471 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -63.79 -33.19 75.11 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.814 1.643 . . . . 0.0 109.57 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -62.34 -24.26 67.23 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 120.665 1.575 . . . . 0.0 111.816 175.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 92.2 t -86.01 -63.4 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 41.5 t -73.13 26.16 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 131.64 3.976 . . . . 0.0 112.71 -175.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -54.25 -26.0 26.41 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 119.751 -1.843 . . . . 0.0 111.643 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -97.37 88.84 4.52 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 175.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -153.08 176.44 11.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.436 0.636 . . . . 0.0 111.003 176.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -108.61 -66.03 1.08 Allowed 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.432 1.093 . . . . 0.0 109.982 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.98 174.88 11.11 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 119.044 0.838 . . . . 0.0 109.464 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . 0.254 0.0 OUTLIER -118.84 169.62 9.7 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.625 1.17 . . . . 0.0 109.599 175.495 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -144.15 149.15 36.02 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 104.205 -2.517 . . . . 0.0 104.205 -175.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.31 123.47 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.8 mp -130.87 145.22 35.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 125.286 1.434 . . . . 0.0 107.889 -176.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 p -136.65 -9.46 1.88 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.741 1.216 . . . . 0.0 113.76 -176.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -115.42 124.46 51.22 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 176.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 17.8 ttp-105 -59.49 -36.68 76.52 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.92 0.888 . . . . 0.0 111.721 -177.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -35.96 77.05 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 120.254 1.388 . . . . 0.0 111.422 177.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.88 -41.52 91.48 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 123.744 0.653 . . . . 0.0 110.324 -175.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -43.61 -23.11 0.06 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 131.456 3.903 . . . . 0.0 115.425 -176.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -43.93 141.41 1.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.014 1.726 . . . . 0.0 111.222 175.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -61.42 -21.84 64.46 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -175.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.471 ' HA ' ' HE3' ' A' ' 129' ' ' LYS 0.276 7.9 t70 -65.81 -43.57 88.27 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 121.541 1.973 . . . . 0.0 113.448 -175.168 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.16 -26.39 60.28 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 113.84 -3.144 . . . . 0.0 106.44 -176.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 58.5 mt -60.64 -49.54 84.04 Favored 'Isoleucine or valine' 0 C--N 1.345 0.39 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 175.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.471 ' HE3' ' HA ' ' A' ' 126' ' ' ASP . 15.4 mtmt -56.26 -45.91 79.88 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.554 -0.716 . . . . 0.0 111.327 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -73.53 -38.17 65.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 119.403 1.002 . . . . 0.0 110.904 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -66.52 -43.73 84.42 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.51 1.524 . . . . 0.0 109.879 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.06 -36.69 82.39 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -67.2 -41.4 85.88 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 124.551 1.14 . . . . 0.0 111.429 175.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -62.02 -41.35 97.99 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 120.832 1.651 . . . . 0.0 109.135 175.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.27 -0.32 14.13 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.667 0.787 . . . . 0.0 112.212 175.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -82.21 64.91 4.17 Favored Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 107.882 -2.087 . . . . 0.0 107.882 175.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -53.29 148.26 15.23 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 108.368 -1.893 . . . . 0.0 108.368 175.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -53.96 94.48 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.916 1.286 . . . . 0.0 112.336 -175.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -129.75 60.78 1.58 Allowed 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 175.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -115.25 90.81 3.43 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 -178.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -145.71 153.61 41.17 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 128.558 2.743 . . . . 0.0 104.913 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.86 78.5 1.25 Allowed 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.203 1.401 . . . . 0.0 107.653 -176.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -75.59 70.72 2.45 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 176.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.9 m 62.9 56.06 1.92 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.738 1.615 . . . . 0.0 108.414 -175.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 . . . . . 0 C--O 1.251 1.171 0 C-N-CA 125.914 1.686 . . . . 0.0 106.646 178.589 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.57 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 5.4 mp -129.09 -104.69 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 N-CA-C 104.948 -2.241 . . . . 0.0 104.948 172.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 6.5 ttp85 -142.28 111.24 6.34 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 105.838 -1.912 . . . . 0.0 105.838 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 6.0 ttt -156.3 141.2 17.16 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 -177.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -115.92 83.74 1.99 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.162 0.985 . . . . 0.0 109.323 175.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 61.2 m -116.23 161.14 19.42 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 103.766 -2.679 . . . . 0.0 103.766 175.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.559 ' HG2' ' H ' ' A' ' 8' ' ' ILE . 38.6 tttt -132.26 -174.01 3.32 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 121.144 -0.973 . . . . 0.0 110.555 -175.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.559 ' H ' ' HG2' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -132.39 151.68 35.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 125.825 1.65 . . . . 0.0 108.298 175.647 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -103.2 86.32 2.66 Favored 'General case' 0 C--O 1.236 0.352 1 N-CA-C 98.488 -4.634 . . . . 0.0 98.488 174.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -55.13 -29.37 57.57 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 116.899 -1.524 . . . . 0.0 113.757 -175.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -74.33 -50.43 18.78 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 120.878 1.672 . . . . 0.0 110.222 -176.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.14 90.0 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.1 m -68.88 -41.95 77.63 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.526 -0.734 . . . . 0.0 112.117 175.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -57.06 -37.62 72.09 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 117.85 -1.071 . . . . 0.0 109.855 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.27 -35.6 69.96 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 119.005 0.82 . . . . 0.0 111.984 -176.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.43 -50.17 12.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 119.185 0.902 . . . . 0.0 111.274 175.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -49.47 -43.76 45.39 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.757 1.223 . . . . 0.0 110.13 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -64.77 -43.38 93.44 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 118.348 -0.834 . . . . 0.0 111.841 -177.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.79 -52.26 65.82 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 119.224 0.92 . . . . 0.0 111.385 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 93.8 t -60.35 -34.27 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 122.439 0.296 . . . . 0.0 110.216 -177.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.4 ttt-85 -72.56 -32.57 66.14 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 125.158 1.383 . . . . 0.0 113.124 176.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.22 149.3 50.54 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.957 1.303 . . . . 0.0 113.887 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.57 -23.21 34.57 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.781 1.233 . . . . 0.0 113.162 -177.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.77 -14.67 24.55 Favored Glycine 0 CA--C 1.527 0.807 0 CA-C-N 118.782 0.719 . . . . 0.0 112.538 -177.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -64.95 123.71 20.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 118.304 1.052 . . . . 0.0 109.214 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.07 -31.94 69.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.248 175.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 t -60.62 129.41 23.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 176.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -114.69 -24.43 3.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 124.075 0.859 . . . . 0.0 110.603 178.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -129.68 137.84 50.84 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.646 1.112 . . . . 0.0 109.685 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 23.6 t -140.6 148.39 22.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 175.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.443 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 42.1 p -105.56 160.32 15.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.133 0.492 . . . . 0.0 111.324 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -129.25 123.08 31.03 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 104.347 -2.464 . . . . 0.0 104.347 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.0 mmtm -100.49 176.66 5.27 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 127.407 2.283 . . . . 0.0 105.921 177.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -115.82 153.62 31.15 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -137.74 152.96 49.75 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 128.991 2.916 . . . . 0.0 105.86 175.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 12.87 -80.33 0.0 OUTLIER Glycine 0 C--N 1.339 0.737 0 C-N-CA 128.038 2.732 . . . . 0.0 115.67 175.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.9 p -129.8 23.91 5.37 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.515 1.126 . . . . 0.0 113.569 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.0 t -151.21 171.63 17.1 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -176.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 12.3 mm -92.93 139.61 17.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 C-N-CA 125.898 1.679 . . . . 0.0 107.439 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.6 m -131.48 153.93 81.73 Favored Pre-proline 0 N--CA 1.472 0.628 0 C-N-CA 124.436 1.094 . . . . 0.0 111.387 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.33 153.71 50.78 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 121.736 1.624 . . . . 0.0 109.491 175.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.69 -142.62 6.97 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 125.484 1.516 . . . . 0.0 110.744 177.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -72.73 165.39 24.9 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.841 1.256 . . . . 0.0 109.755 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -145.08 165.1 29.21 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 125.772 1.629 . . . . 0.0 110.809 177.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.6 173.78 42.01 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-O 122.731 1.184 . . . . 0.0 112.962 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.46 7.47 5.34 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.484 2.314 . . . . 0.0 110.093 176.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -133.03 127.04 33.21 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 103.422 -2.807 . . . . 0.0 103.422 -175.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -84.43 -15.99 44.22 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 115.611 1.708 . . . . 0.0 115.611 -175.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -58.7 -40.19 82.92 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 121.959 2.163 . . . . 0.0 109.937 176.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -60.47 -30.58 69.77 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.767 0.427 . . . . 0.0 111.039 175.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -69.66 -36.12 75.77 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.539 -0.726 . . . . 0.0 109.652 178.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.5 mm -62.87 -46.95 95.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -63.6 -35.96 82.23 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.863 1.665 . . . . 0.0 111.926 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.0 -22.98 65.04 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 124.716 1.207 . . . . 0.0 114.049 177.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.9 m -64.23 113.99 3.94 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 119.377 0.989 . . . . 0.0 108.83 -178.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.833 ' HG1' ' CG2' ' A' ' 59' ' ' VAL 0.254 2.3 p -103.36 154.85 18.96 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.495 1.118 . . . . 0.0 108.168 179.628 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -41.48 -74.76 0.03 OUTLIER 'General case' 0 C--O 1.234 0.272 0 N-CA-C 117.943 2.572 . . . . 0.0 117.943 -174.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -106.17 -36.14 6.99 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -175.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.833 ' CG2' ' HG1' ' A' ' 56' ' ' THR . 15.7 m -53.75 132.16 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 123.235 0.614 . . . . 0.0 110.265 -175.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.51 123.11 46.3 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 -177.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 32.7 tp -122.42 176.11 6.07 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 127.023 2.129 . . . . 0.0 111.284 -174.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -136.48 151.76 49.81 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.49 0.716 . . . . 0.0 110.233 176.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.443 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -142.92 123.42 13.99 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.739 0.815 . . . . 0.0 111.295 175.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -88.41 123.88 33.4 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 104.65 -2.352 . . . . 0.0 104.65 175.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.4 t -134.28 140.54 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-N 118.103 0.41 . . . . 0.0 109.919 -175.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.9 tmm_? -85.42 117.84 24.59 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 175.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -112.23 123.45 50.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 108.696 -175.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.1 m -73.78 116.14 14.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 176.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 85.6 m -84.31 169.72 14.38 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 124.429 1.091 . . . . 0.0 110.564 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -56.2 130.36 49.3 Favored Glycine 0 C--N 1.34 0.798 0 N-CA-C 108.304 -1.918 . . . . 0.0 108.304 176.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.91 160.73 22.79 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 126.355 1.862 . . . . 0.0 113.302 -175.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.51 -173.62 4.25 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 130.221 3.408 . . . . 0.0 106.3 175.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -63.51 -5.87 4.35 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.414 -0.804 . . . . 0.0 112.371 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.1 m -135.74 158.27 44.81 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 127.599 2.359 . . . . 0.0 106.794 175.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -57.09 150.2 17.75 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 123.455 0.702 . . . . 0.0 109.703 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 75.2 mmt-85 -135.4 134.04 39.29 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 175.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.2 t -146.59 139.12 25.11 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 124.461 1.105 . . . . 0.0 108.316 -176.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -142.41 176.63 8.85 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.508 1.523 . . . . 0.0 107.214 177.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -131.52 124.35 29.91 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 -176.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -111.56 114.12 26.98 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 104.108 -2.553 . . . . 0.0 104.108 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.9 tt -82.88 113.15 20.3 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 105.361 -2.088 . . . . 0.0 105.361 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.1 mp -79.4 123.8 36.8 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 N-CA-C 105.458 -2.053 . . . . 0.0 105.458 175.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.8 m -106.4 123.11 47.57 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 101.242 -3.614 . . . . 0.0 101.242 175.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -95.49 124.06 39.34 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.5 mm -133.94 81.92 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 N-CA-C 103.696 -2.705 . . . . 0.0 103.696 177.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -44.26 130.47 7.09 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 107.986 -2.046 . . . . 0.0 107.986 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -56.0 -10.64 0.84 Allowed 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -83.21 -28.17 29.45 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 117.576 -1.202 . . . . 0.0 110.804 177.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.7 p -71.03 133.53 31.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 120.744 1.611 . . . . 0.0 109.064 -177.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 42.5 t -146.31 176.18 9.96 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.84 1.656 . . . . 0.0 107.011 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.65 -157.2 53.52 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.1 tt -60.23 -30.98 69.76 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-O 118.049 -0.977 . . . . 0.0 112.047 -175.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -58.17 -45.15 87.98 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 120.304 1.411 . . . . 0.0 110.109 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -36.25 76.98 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 175.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.32 -23.57 66.82 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.084 -0.96 . . . . 0.0 112.573 177.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -56.19 -54.35 46.25 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-N 119.919 1.236 . . . . 0.0 108.861 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 54.0 m -52.28 -40.41 61.72 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 175.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -55.4 -24.78 39.22 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-O 118.864 -0.964 . . . . 0.0 115.415 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.2 m -115.7 -6.64 12.15 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.184 1.492 . . . . 0.0 112.201 176.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -103.91 -23.46 13.36 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 125.733 1.613 . . . . 0.0 111.974 -175.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.4 mtmp? -53.31 -29.88 36.0 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.44 1.473 . . . . 0.0 111.981 176.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -63.69 -36.83 85.15 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.942 0.897 . . . . 0.0 111.137 176.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 18.1 mt -64.81 -62.27 1.67 Allowed 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 125.363 1.465 . . . . 0.0 108.723 -176.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.264 0.9 OUTLIER -61.14 -28.1 43.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.472 176.354 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 34.1 tttm -62.14 -40.56 96.35 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 121.246 1.839 . . . . 0.0 109.43 175.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -57.51 -24.51 56.33 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.687 1.13 . . . . 0.0 112.253 177.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 55.3 t -84.62 -63.24 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 87.1 t -65.22 26.46 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.873 1 C-N-CA 132.289 4.236 . . . . 0.0 113.644 -175.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -54.12 -27.05 30.81 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 119.314 -2.116 . . . . 0.0 114.035 -175.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -90.78 79.86 5.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 175.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -148.58 176.32 10.43 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 122.375 0.27 . . . . 0.0 110.591 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.42 -59.29 2.02 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.982 0.913 . . . . 0.0 111.04 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -147.54 171.94 14.77 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 125.335 1.454 . . . . 0.0 110.248 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -123.51 134.02 53.93 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -107.1 144.37 33.89 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 104.998 -2.223 . . . . 0.0 104.998 -174.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.6 t -104.0 123.54 57.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 175.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 98.9 mt -129.08 137.25 57.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 106.225 -1.768 . . . . 0.0 106.225 -175.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.5 p -142.69 -4.01 0.98 Allowed 'General case' 0 C--O 1.239 0.528 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -175.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -146.82 152.13 38.24 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.103 1.361 . . . . 0.0 109.229 -175.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -60.11 -36.17 76.85 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 117.313 -1.327 . . . . 0.0 112.361 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -63.08 -37.45 87.27 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 121.273 1.851 . . . . 0.0 110.584 176.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -68.13 -23.17 64.86 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.108 2.163 . . . . 0.0 111.485 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -84.82 -23.37 29.13 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.256 1.822 . . . . 0.0 113.349 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -59.35 125.76 24.9 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 120.102 1.319 . . . . 0.0 112.12 -175.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -56.9 -27.93 61.33 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.254 -0.904 . . . . 0.0 113.316 176.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -54.59 -60.68 3.03 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 123.575 0.75 . . . . 0.0 111.249 -177.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -80.56 -24.22 39.39 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 117.769 -1.572 . . . . 0.0 109.017 -175.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 27.8 mt -54.47 -47.34 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 175.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -54.09 -49.89 68.07 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 118.78 0.718 . . . . 0.0 112.038 175.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.8 t -71.91 -29.16 64.02 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.598 0.635 . . . . 0.0 111.661 -176.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -72.11 -47.14 53.43 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 119.301 0.955 . . . . 0.0 109.165 176.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 78.0 mt -60.17 -36.95 78.73 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 175.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.0 mtmt -61.68 -53.21 59.21 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 175.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? -57.05 -45.77 82.96 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.976 1.262 . . . . 0.0 111.209 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.68 -3.67 23.06 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 117.964 -1.017 . . . . 0.0 112.873 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -106.06 155.82 16.59 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 108.901 -1.68 . . . . 0.0 108.901 175.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 158.26 95.34 0.11 Allowed Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 107.658 -2.177 . . . . 0.0 107.658 -176.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -154.65 137.73 15.57 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 125.902 1.681 . . . . 0.0 107.606 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -69.52 117.91 11.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -114.32 100.47 8.36 Favored 'General case' 0 N--CA 1.438 -1.036 0 N-CA-C 100.971 -3.714 . . . . 0.0 100.971 175.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -63.39 156.73 25.08 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 125.112 1.365 . . . . 0.0 109.737 -175.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -132.2 94.81 3.53 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -178.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -143.73 129.23 19.05 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 101.411 -3.551 . . . . 0.0 101.411 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 63.85 31.86 13.74 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -175.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 . . . . . 0 C--O 1.244 0.801 1 C-N-CA 133.694 4.798 . . . . 0.0 103.572 -177.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.675 0 N-CA-C 111.161 -0.776 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.3 tt -87.8 150.87 3.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 166.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.52 64.63 1.65 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 122.101 0.953 . . . . 0.0 109.044 175.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 8.6 ttm -150.17 175.46 11.74 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 128.277 2.631 . . . . 0.0 105.564 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.53 144.57 56.89 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.541 1.064 . . . . 0.0 109.712 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.2 m -142.6 162.07 36.42 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.565 1.946 . . . . 0.0 106.621 -176.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.1 mtpt -131.62 -173.06 3.02 Favored 'General case' 0 CA--C 1.516 -0.328 0 O-C-N 121.316 -0.865 . . . . 0.0 111.303 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.13 148.38 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 C-N-CA 126.908 2.083 . . . . 0.0 105.654 175.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -88.31 74.05 8.74 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 101.9 -3.37 . . . . 0.0 101.9 175.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.85 -44.61 59.52 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 125.391 1.477 . . . . 0.0 112.875 -174.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -65.47 -49.34 69.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.083 0.856 . . . . 0.0 109.738 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.56 -34.39 74.11 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.322 -0.861 . . . . 0.0 112.0 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.5 m -74.78 -38.02 62.27 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.451 178.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.2 ttm180 -59.95 -27.25 66.65 Favored 'General case' 0 C--N 1.342 0.263 0 CA-C-O 116.975 -1.488 . . . . 0.0 111.17 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.06 -60.78 3.24 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 120.089 1.313 . . . . 0.0 110.465 176.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.38 -40.2 95.66 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.013 0.824 . . . . 0.0 111.073 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -58.77 -36.34 74.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.545 176.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -62.19 -44.96 95.41 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 119.925 1.239 . . . . 0.0 110.604 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.6 mp -56.68 -61.84 2.14 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 175.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 42.3 t -58.21 -34.44 49.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 O-C-N 121.742 -0.599 . . . . 0.0 111.498 -176.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.2 ttt-85 -67.71 -38.16 83.25 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 124.683 1.193 . . . . 0.0 111.213 175.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -66.56 137.07 56.5 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.891 0.876 . . . . 0.0 108.737 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.6 -11.06 57.8 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 125.279 1.432 . . . . 0.0 111.373 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -98.45 5.85 60.82 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.724 1.63 . . . . 0.0 112.225 175.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -85.63 141.55 29.72 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.248 1.524 . . . . 0.0 109.936 176.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -80.28 -29.0 38.24 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 175.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.9 t -73.62 125.03 32.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 175.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 pp -115.16 -24.49 3.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.816 1.246 . . . . 0.0 111.312 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.0 p-90 -125.38 145.21 50.15 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 119.224 0.92 . . . . 0.0 108.777 177.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.1 t -135.71 158.84 39.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 127.389 2.276 . . . . 0.0 106.151 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 42.0 p -119.15 154.5 33.19 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -126.69 123.58 37.85 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 176.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -107.04 176.72 5.08 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.171 2.188 . . . . 0.0 105.347 -175.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -116.94 155.53 28.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.485 0.659 . . . . 0.0 109.509 176.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -142.26 166.71 23.94 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 127.306 2.242 . . . . 0.0 105.906 175.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 14.07 -88.78 0.0 OUTLIER Glycine 0 CA--C 1.531 1.06 0 C-N-CA 128.385 2.898 . . . . 0.0 114.988 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 p -135.59 44.17 2.55 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 126.24 1.816 . . . . 0.0 109.312 175.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -155.1 174.29 15.39 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -176.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.3 mm -103.47 139.55 24.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 126.22 1.808 . . . . 0.0 106.968 175.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 16.6 m -135.66 160.54 67.25 Favored Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 124.98 1.312 . . . . 0.0 110.902 -178.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.87 149.11 53.15 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.525 2.15 . . . . 0.0 110.444 175.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -115.43 -145.95 8.72 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 126.706 2.098 . . . . 0.0 109.676 175.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -70.26 164.65 23.92 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -144.95 168.64 19.76 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.849 1.26 . . . . 0.0 108.49 175.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.81 174.92 46.91 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-O 121.88 0.711 . . . . 0.0 113.076 -177.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.64 -26.07 8.81 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.693 1.997 . . . . 0.0 110.691 176.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.02 129.18 55.45 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 -176.116 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -83.94 -8.5 59.15 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.404 1.261 . . . . 0.0 114.404 -174.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -58.56 -40.12 82.18 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 119.497 -2.002 . . . . 0.0 109.048 175.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -66.48 -22.54 66.19 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.597 -0.689 . . . . 0.0 111.601 176.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -66.61 -36.25 82.14 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-N 119.472 1.033 . . . . 0.0 109.801 176.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.9 mm -60.02 -39.7 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -72.7 -23.35 60.86 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.849 1.66 . . . . 0.0 113.313 175.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -73.97 -24.92 59.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 120.79 1.632 . . . . 0.0 110.036 175.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 79.9 m -71.56 159.37 34.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.598 -0.689 . . . . 0.0 109.432 176.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.7 p -132.63 -174.33 3.43 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.73 1.212 . . . . 0.0 112.644 -175.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -77.01 -67.46 0.71 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.304 1.442 . . . . 0.0 108.448 175.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -106.45 -27.92 10.64 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 -175.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.5 m -65.58 167.77 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-N 121.997 2.18 . . . . 0.0 113.428 -175.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.2 124.87 45.74 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 175.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 56.2 tp -129.02 159.09 37.02 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 126.171 1.788 . . . . 0.0 107.962 -175.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -123.81 157.82 33.21 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.442 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -147.2 141.62 26.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 118.126 0.421 . . . . 0.0 111.319 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -106.54 123.58 48.31 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 176.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.2 t -135.62 138.15 48.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.834 0.826 . . . . 0.0 112.136 -175.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.5 ttm-85 -79.33 117.71 20.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 128.388 2.675 . . . . 0.0 107.15 175.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -136.18 167.75 20.69 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.7 m -128.67 130.44 47.22 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 120.8 -1.187 . . . . 0.0 107.804 175.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 m -154.84 121.51 5.42 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 175.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 75.29 121.72 0.12 Allowed Glycine 0 C--N 1.332 0.338 0 N-CA-C 107.162 -2.375 . . . . 0.0 107.162 -175.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . 0.275 6.1 m-20 -118.22 176.43 5.23 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.237 -0.981 . . . . 0.0 112.052 -175.099 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.46 ' C ' ' H ' ' A' ' 74' ' ' SER . . . -144.49 -173.01 3.92 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 127.968 2.507 . . . . 0.0 107.317 -175.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 57.6 mtm -54.46 -5.85 0.09 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.923 0.889 . . . . 0.0 112.867 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.46 ' H ' ' C ' ' A' ' 72' ' ' ALA . 75.3 m -146.15 150.26 35.55 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 130.088 3.355 . . . . 0.0 103.76 175.141 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -64.37 158.5 23.47 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.661 -176.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.9 mtt180 -116.61 170.87 8.25 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.7 t -145.64 124.3 12.54 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 175.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -116.64 123.35 47.07 Favored 'General case' 0 CA--C 1.5 -0.979 0 C-N-CA 125.753 1.621 . . . . 0.0 107.361 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -86.31 131.46 34.21 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.713 -1.131 . . . . 0.0 108.683 -178.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.68 122.19 45.56 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -95.21 113.22 24.88 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 101.029 -3.693 . . . . 0.0 101.029 174.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -97.41 143.17 13.05 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 -176.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.7 m -126.18 123.5 38.37 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 175.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.3 t-105 -100.85 128.09 47.03 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 104.021 -2.585 . . . . 0.0 104.021 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 mt -132.27 103.03 6.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 104.27 -2.492 . . . . 0.0 104.27 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.7 138.09 15.18 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 176.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -66.62 -7.22 18.93 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.747 -1.443 . . . . 0.0 111.953 -176.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -85.45 -34.78 21.58 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 117.188 -1.387 . . . . 0.0 113.072 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.39 124.1 18.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 120.941 1.701 . . . . 0.0 109.863 -175.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.8 t -65.82 162.13 19.5 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 122.616 1.198 . . . . 0.0 113.262 -175.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.02 -30.07 72.55 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 125.32 1.438 . . . . 0.0 113.715 -176.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.7 -46.95 87.5 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 118.478 1.139 . . . . 0.0 108.355 175.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -67.48 -41.96 83.71 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 123.171 0.588 . . . . 0.0 109.526 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -58.74 -24.95 62.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.739 0.7 . . . . 0.0 110.408 175.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.97 -39.17 93.87 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.061 -1.024 . . . . 0.0 110.531 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.65 -41.53 77.36 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 118.979 0.809 . . . . 0.0 108.849 176.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 m -59.1 -30.25 67.97 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.636 -176.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -70.88 -26.38 74.08 Favored Glycine 0 CA--C 1.532 1.128 0 CA-C-N 119.739 1.154 . . . . 0.0 112.448 175.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 33.5 m -89.48 -10.92 44.54 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.425 1.49 . . . . 0.0 109.974 175.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -103.46 -27.82 12.16 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.422 -0.799 . . . . 0.0 111.375 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -53.5 -51.94 61.18 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 119.767 1.167 . . . . 0.0 109.745 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -58.67 -34.62 71.46 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 123.455 0.702 . . . . 0.0 110.88 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 14.8 mt -64.09 -62.39 1.66 Allowed 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 124.014 0.926 . . . . 0.0 110.074 178.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.253 0.9 OUTLIER -60.32 -25.72 34.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 118.481 -1.288 . . . . 0.0 110.224 176.503 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -67.92 -26.41 65.96 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 120.534 1.515 . . . . 0.0 109.729 175.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.68 -25.98 68.45 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.957 1.708 . . . . 0.0 110.729 175.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 79.0 t -86.16 -58.01 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 175.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 60.7 t -73.4 26.32 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 130.358 3.463 . . . . 0.0 111.695 -175.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.43 -26.19 64.97 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 119.814 -1.804 . . . . 0.0 111.261 -176.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -91.94 70.91 5.55 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 175.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.13 175.94 8.94 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.044 0.449 . . . . 0.0 111.001 176.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.85 -66.33 0.94 Allowed 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 108.696 -0.854 . . . . 0.0 108.696 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.97 175.08 13.44 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 128.343 2.657 . . . . 0.0 107.233 175.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -100.52 178.5 4.71 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 124.509 1.124 . . . . 0.0 112.692 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -143.43 144.54 32.07 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 103.712 -2.699 . . . . 0.0 103.712 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 57.5 t -123.22 131.12 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 175.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -129.64 147.99 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 126.551 1.94 . . . . 0.0 109.335 -175.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.3 p -146.02 9.42 1.13 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.507 1.123 . . . . 0.0 113.08 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -142.51 147.11 35.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -178.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -62.59 -24.22 67.45 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 119.777 1.172 . . . . 0.0 110.213 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -68.34 -55.05 13.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 175.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -56.73 -23.48 42.84 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.706 1.602 . . . . 0.0 111.073 175.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -79.68 -22.84 42.96 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.491 1.916 . . . . 0.0 113.482 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -60.22 124.77 21.29 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 119.488 1.04 . . . . 0.0 112.667 -177.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -58.27 -26.71 63.29 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 176.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -48.71 -66.32 0.42 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.181 1.792 . . . . 0.0 111.182 177.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -78.19 -21.76 49.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 117.077 -1.849 . . . . 0.0 108.768 -176.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 72.6 mt -55.13 -43.02 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 120.03 1.286 . . . . 0.0 107.793 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -54.18 -54.07 44.76 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 119.709 1.14 . . . . 0.0 111.393 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 47.5 t -67.19 -36.28 81.42 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.785 0.721 . . . . 0.0 111.103 -177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -61.7 -48.86 78.85 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.048 1.339 . . . . 0.0 109.402 176.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.68 -36.42 83.78 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.284 177.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -61.54 -55.55 29.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 175.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -56.01 -52.2 65.05 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 127.333 2.253 . . . . 0.0 111.5 -178.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.57 -25.74 67.55 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 121.393 -0.817 . . . . 0.0 111.798 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -84.84 -37.86 9.93 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 125.059 1.314 . . . . 0.0 113.396 -176.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -169.28 178.69 42.31 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-N 119.034 1.417 . . . . 0.0 111.436 -176.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.09 119.14 8.34 Favored 'General case' 0 CA--C 1.527 0.086 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -104.44 105.17 15.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -119.57 103.89 9.81 Favored 'General case' 0 N--CA 1.445 -0.681 1 N-CA-C 99.252 -4.351 . . . . 0.0 99.252 175.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -117.52 108.37 15.42 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 103.016 -2.957 . . . . 0.0 103.016 -175.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -131.71 136.66 47.81 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 126.154 1.782 . . . . 0.0 110.26 -175.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -78.22 25.38 0.23 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.458 2.303 . . . . 0.0 111.634 -178.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.2 m 85.83 56.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 128.428 2.691 . . . . 0.0 105.482 -174.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 . . . . . 0 C--O 1.246 0.893 0 C-N-CA 129.463 3.105 . . . . 0.0 104.549 -177.096 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.911 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.0 pt -134.55 -178.4 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 117.929 0.865 . . . . 0.0 110.246 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.27 135.98 56.74 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.43 166.15 34.25 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 127.223 2.209 . . . . 0.0 107.026 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -125.43 43.85 2.96 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 123.203 1.478 . . . . 0.0 110.043 175.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.4 m -96.27 171.24 8.71 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 127.463 2.305 . . . . 0.0 105.597 175.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.4 tttp -138.85 -170.95 2.97 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 120.787 -1.196 . . . . 0.0 111.268 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -140.2 151.36 21.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 124.342 1.057 . . . . 0.0 111.193 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -95.44 79.05 3.42 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 101.37 -3.567 . . . . 0.0 101.37 174.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -58.63 -33.08 69.64 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 116.569 -1.681 . . . . 0.0 112.188 -175.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -73.54 -54.32 8.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 119.283 0.947 . . . . 0.0 109.199 -176.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.67 -35.5 76.4 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 119.529 -0.272 . . . . 0.0 111.011 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.6 m -76.74 -32.3 57.68 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 117.811 -1.09 . . . . 0.0 110.819 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.78 -37.96 77.46 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 116.326 -1.797 . . . . 0.0 108.621 177.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.7 -61.62 2.19 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 119.521 1.055 . . . . 0.0 108.966 -177.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.12 -33.82 75.22 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.612 -0.68 . . . . 0.0 111.236 -176.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -59.32 -38.59 80.66 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.417 0.687 . . . . 0.0 110.239 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -66.06 -45.06 82.67 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 124.636 1.175 . . . . 0.0 109.04 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -54.69 -57.52 11.17 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 118.716 0.689 . . . . 0.0 109.267 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.6 t -61.07 -24.07 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 123.085 0.554 . . . . 0.0 112.335 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 -45.03 15.52 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 121.177 -0.952 . . . . 0.0 109.474 175.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -51.53 123.33 9.64 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 126.66 1.984 . . . . 0.0 110.943 -175.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -73.41 -9.87 59.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.489 -176.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.46 -8.09 50.24 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-O 118.914 -0.937 . . . . 0.0 112.576 175.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.6 t -68.39 148.03 51.25 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 118.744 1.272 . . . . 0.0 111.176 -175.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.13 -36.03 19.82 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.051 -1.432 . . . . 0.0 107.185 174.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.7 t -68.91 123.89 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.91 -24.46 3.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 124.392 1.077 . . . . 0.0 110.642 177.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -121.59 142.45 50.09 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.866 1.266 . . . . 0.0 108.179 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.3 t -137.98 160.19 33.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 126.606 1.962 . . . . 0.0 106.652 176.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 76.9 p -126.75 156.87 40.5 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 175.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -129.83 130.94 45.92 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.0 mmmt -103.8 176.1 5.26 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -123.88 139.79 53.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 176.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -131.54 123.3 27.69 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 175.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 47.31 -100.85 0.03 OUTLIER Glycine 0 CA--C 1.525 0.691 0 C-N-CA 124.606 1.098 . . . . 0.0 112.105 -176.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.3 p -120.23 42.72 2.89 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.617 1.167 . . . . 0.0 111.91 177.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.2 t -152.83 160.69 43.1 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.799 1.181 . . . . 0.0 111.4 175.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 21.3 mm -90.79 136.33 24.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -131.63 163.58 48.75 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 124.493 1.117 . . . . 0.0 109.976 178.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.97 164.63 34.05 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.017 1.811 . . . . 0.0 111.242 175.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.1 -146.92 5.79 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 126.312 1.911 . . . . 0.0 108.856 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.81 161.12 26.89 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.878 1.271 . . . . 0.0 110.852 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.27 153.78 36.75 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.307 1.843 . . . . 0.0 110.266 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 174.5 -172.28 45.26 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-N 119.209 0.913 . . . . 0.0 113.279 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.69 -20.47 10.09 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 126.28 1.832 . . . . 0.0 113.002 -176.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -109.18 123.09 48.66 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 -176.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -82.35 -6.62 59.38 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.257 0.623 . . . . 0.0 112.49 -175.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -57.31 -29.29 63.8 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 120.83 -1.169 . . . . 0.0 112.7 177.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -74.6 -36.2 62.97 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.201 1.0 . . . . 0.0 111.239 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -56.76 -40.98 76.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 126.837 2.055 . . . . 0.0 109.087 -176.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.8 mm -55.57 -44.04 74.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 124.043 0.937 . . . . 0.0 108.583 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -85.43 -27.77 25.53 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.229 1.012 . . . . 0.0 111.988 -178.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -63.56 -27.26 69.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 118.323 -0.846 . . . . 0.0 111.259 176.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 75.4 m -60.8 120.45 10.14 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.252 2.1 p -83.96 158.94 21.37 Favored 'General case' 0 N--CA 1.437 -1.078 0 C-N-CA 125.339 1.455 . . . . 0.0 108.992 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -50.41 -73.77 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 126.668 1.987 . . . . 0.0 115.499 -175.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -105.83 -36.49 7.0 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.161 1.385 . . . . 0.0 113.703 -175.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.8 m -60.8 159.86 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.452 0.701 . . . . 0.0 111.857 -175.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.77 151.04 23.52 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.197 0.599 . . . . 0.0 109.443 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.8 tp -150.6 168.04 25.47 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.383 1.473 . . . . 0.0 108.494 -176.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -131.58 154.95 48.32 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.079 0.551 . . . . 0.0 109.688 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.462 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -147.36 167.52 24.12 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 123.453 0.701 . . . . 0.0 112.339 176.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -141.09 123.28 15.65 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.8 t -136.12 130.79 48.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.03 114.14 16.61 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 176.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -118.24 170.75 8.63 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 124.36 1.064 . . . . 0.0 108.641 -175.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 89.8 m -136.34 116.76 13.7 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 120.451 -1.406 . . . . 0.0 110.558 -175.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.8 m -151.93 152.61 32.75 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.842 0.857 . . . . 0.0 111.756 179.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.14 172.97 49.59 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 -176.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -139.29 144.24 38.25 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 117.749 0.774 . . . . 0.0 109.943 -175.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.8 -179.14 6.58 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 127.965 2.506 . . . . 0.0 106.024 175.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 96.4 mtp -71.33 -5.64 33.98 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.415 0.686 . . . . 0.0 110.786 175.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.0 m -133.58 170.25 15.8 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 127.913 2.485 . . . . 0.0 107.827 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.9 mtmt -61.46 160.08 11.67 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.4 0.619 . . . . 0.0 110.522 176.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 -123.48 158.74 30.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 175.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.1 t -146.16 137.39 24.6 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 175.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -140.34 123.89 17.08 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -87.89 141.17 28.8 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.5 114.72 23.88 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.085 1.354 . . . . 0.0 109.282 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.33 113.57 21.24 Favored 'General case' 0 C--O 1.225 -0.237 0 N-CA-C 103.664 -2.717 . . . . 0.0 103.664 175.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.2 mt -105.31 142.66 17.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 m -126.27 123.57 38.4 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 175.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.7 t-105 -90.29 123.44 34.06 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 103.798 -2.668 . . . . 0.0 103.798 175.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 4.7 mm -137.56 86.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 103.563 -2.754 . . . . 0.0 103.563 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.76 147.36 6.89 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -54.29 -21.82 10.28 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.897 0.702 . . . . 0.0 112.897 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -83.12 -34.76 26.01 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 117.321 -1.323 . . . . 0.0 112.078 -175.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.82 136.09 26.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 120.489 1.495 . . . . 0.0 109.88 -178.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.7 t -145.82 176.71 9.46 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 127.125 2.17 . . . . 0.0 107.396 -176.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.72 -156.81 53.52 Favored Glycine 0 N--CA 1.45 -0.405 0 CA-C-O 121.535 0.519 . . . . 0.0 112.148 175.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 tt -51.63 -36.78 47.39 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.799 1.24 . . . . 0.0 111.269 -176.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.4 mp0 -63.7 -35.68 81.35 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 119.565 1.075 . . . . 0.0 112.141 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -76.06 -49.72 16.71 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 175.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.22 -29.21 63.55 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.299 1.44 . . . . 0.0 113.296 -175.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -48.47 -37.74 18.19 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 119.778 1.172 . . . . 0.0 111.415 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 20.3 m -58.16 -32.28 68.04 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.889 0.768 . . . . 0.0 111.893 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.24 -25.97 72.46 Favored Glycine 0 CA--C 1.53 0.985 0 O-C-N 120.86 -1.15 . . . . 0.0 112.34 177.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.5 m -105.75 -16.69 14.6 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.489 1.915 . . . . 0.0 111.633 -176.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -103.95 -25.85 12.87 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 126.086 1.754 . . . . 0.0 112.073 -175.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 19.3 mtmt -56.67 -26.65 56.96 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.453 1.479 . . . . 0.0 112.311 175.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -62.3 -38.31 88.88 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 118.942 0.792 . . . . 0.0 109.84 176.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 39.6 mt -68.88 -61.41 1.81 Allowed 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 125.849 1.66 . . . . 0.0 109.576 -176.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.286 1.4 p -55.89 -30.87 29.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 118.052 -0.975 . . . . 0.0 108.514 176.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.55 -39.06 93.43 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 120.626 1.557 . . . . 0.0 109.617 175.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -54.95 -29.04 55.66 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 121.487 1.949 . . . . 0.0 111.701 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 79.7 t -86.1 -52.35 12.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 119.258 0.935 . . . . 0.0 109.227 175.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.2 t -79.21 14.82 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 129.432 3.093 . . . . 0.0 115.116 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -55.72 -26.21 44.17 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 122.381 2.355 . . . . 0.0 112.866 -176.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -84.85 63.7 8.19 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 175.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -137.47 176.4 8.74 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.674 0.789 . . . . 0.0 109.52 176.14 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.93 -66.38 1.0 Allowed 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 124.096 0.873 . . . . 0.0 110.216 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -148.26 176.21 10.44 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.818 1.647 . . . . 0.0 109.614 -176.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -121.37 171.94 8.4 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 125.021 1.328 . . . . 0.0 111.467 -177.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -145.61 147.98 32.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 17.2 t -126.32 125.68 67.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 175.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.3 mt -121.79 143.93 32.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 125.979 1.712 . . . . 0.0 109.214 -175.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.9 p -137.42 1.39 2.39 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -142.87 153.43 43.14 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -177.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -62.52 -38.74 91.14 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.719 0.69 . . . . 0.0 110.237 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -61.47 -45.28 94.94 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 119.091 0.859 . . . . 0.0 109.232 175.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -62.47 -23.94 67.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.813 1.245 . . . . 0.0 111.011 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -83.68 -23.86 31.54 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.074 1.75 . . . . 0.0 113.02 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -62.65 124.07 20.02 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.75 0.705 . . . . 0.0 112.127 -175.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.71 -26.07 66.88 Favored 'General case' 0 CA--C 1.527 0.077 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -56.7 -45.18 81.98 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -175.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -89.61 -24.42 21.68 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 117.961 -1.019 . . . . 0.0 109.102 178.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 24.8 mt -56.68 -40.92 72.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 N-CA-C 106.65 -1.611 . . . . 0.0 106.65 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.3 mtpm? -53.59 -52.46 59.72 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 118.593 0.633 . . . . 0.0 110.215 175.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 9.2 t -65.64 -37.94 87.96 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.468 0.707 . . . . 0.0 111.108 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -61.4 -53.88 50.82 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.85 1.66 . . . . 0.0 108.934 177.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 76.2 mt -62.0 -34.18 75.71 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 125.103 1.361 . . . . 0.0 110.098 175.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.03 -50.25 74.1 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 120.434 1.47 . . . . 0.0 110.643 175.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt -62.01 -49.65 75.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 120.352 1.433 . . . . 0.0 109.08 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -76.08 16.77 0.4 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.227 1.011 . . . . 0.0 111.988 175.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -69.74 -8.05 59.79 Favored Glycine 0 C--N 1.335 0.483 0 C-N-CA 125.971 1.748 . . . . 0.0 116.115 -174.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 63.59 62.04 5.68 Favored Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 107.589 -2.204 . . . . 0.0 107.589 -175.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.54 161.46 1.44 Allowed 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.783 0.833 . . . . 0.0 110.398 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -119.96 132.19 55.43 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -126.34 99.02 5.67 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 101.737 -3.431 . . . . 0.0 101.737 177.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -134.35 159.18 41.84 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.381 1.073 . . . . 0.0 110.553 -175.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -146.33 136.29 23.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.524 1.53 . . . . 0.0 107.125 177.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -140.66 151.64 44.74 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 104.999 -2.222 . . . . 0.0 104.999 176.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.7 m 85.72 56.56 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.78 2.032 . . . . 0.0 105.833 -175.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 . . . . . 0 C--O 1.257 1.487 0 N-CA-C 103.915 -2.624 . . . . 0.0 103.915 175.859 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.904 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 16.8 tt -53.55 112.76 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 122.608 1.194 . . . . 0.0 112.211 -156.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.37 156.48 42.13 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 129.058 2.943 . . . . 0.0 105.17 176.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 22.9 ttp -129.57 173.87 10.19 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 105.275 -2.12 . . . . 0.0 105.275 175.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -71.64 82.18 0.85 Allowed 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 175.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.6 m -63.56 157.72 22.97 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.005 1.722 . . . . 0.0 106.644 176.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.96 -173.04 2.66 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 120.668 -1.27 . . . . 0.0 112.021 -175.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.66 149.26 29.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 124.005 0.922 . . . . 0.0 109.413 177.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -94.6 71.08 3.61 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 103.554 -2.758 . . . . 0.0 103.554 175.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -56.67 -34.09 67.03 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-O 117.909 -1.044 . . . . 0.0 111.517 -175.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -70.09 -38.67 75.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 119.828 1.194 . . . . 0.0 110.615 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.81 -49.32 18.41 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 121.827 -0.546 . . . . 0.0 110.057 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.3 m -62.1 -38.02 87.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.699 -0.626 . . . . 0.0 111.56 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -62.49 -31.59 72.37 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 116.289 -1.815 . . . . 0.0 110.327 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.38 -54.38 47.48 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 120.766 1.621 . . . . 0.0 110.727 178.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.59 -40.06 73.47 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.516 -0.74 . . . . 0.0 111.486 -178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -55.66 -43.01 75.9 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 118.406 -0.807 . . . . 0.0 109.683 176.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -57.54 -45.0 85.61 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.487 1.115 . . . . 0.0 111.043 -177.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mp -59.45 -63.04 1.44 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.324 0.65 . . . . 0.0 110.099 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.5 t -58.35 -30.56 40.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 123.108 0.563 . . . . 0.0 111.84 -176.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.24 -28.2 63.0 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.894 1.277 . . . . 0.0 111.342 175.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -71.18 155.73 40.4 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.682 0.673 . . . . 0.0 109.7 -174.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -86.43 -18.5 31.57 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.954 1.302 . . . . 0.0 113.297 177.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.29 -2.43 38.38 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 125.155 1.359 . . . . 0.0 114.586 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.3 t -69.66 135.34 49.77 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 119.574 1.687 . . . . 0.0 110.407 -178.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.74 -25.52 56.63 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 55.2 t -78.27 123.9 35.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 175.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.2 pp -112.66 -23.7 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.673 1.189 . . . . 0.0 111.155 -176.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 38.2 p-90 -130.05 153.69 48.19 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 122.013 0.911 . . . . 0.0 111.008 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.2 t -139.6 165.89 21.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 128.579 2.752 . . . . 0.0 108.622 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.465 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 30.9 p -126.0 160.86 28.92 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.487 1.115 . . . . 0.0 109.0 175.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -132.86 126.67 32.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.8 mmmt -109.44 171.5 7.41 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.421 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 49.6 m-85 -121.65 143.68 49.2 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 175.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -139.19 123.54 18.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 35.43 -98.98 0.01 OUTLIER Glycine 0 CA--C 1.532 1.099 0 C-N-CA 126.916 2.198 . . . . 0.0 115.068 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 m -104.4 18.3 22.43 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.253 1.421 . . . . 0.0 113.941 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.2 t -146.37 169.0 19.75 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 120.748 1.613 . . . . 0.0 114.166 -175.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.421 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 17.5 mm -99.21 132.96 43.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 104.39 -2.448 . . . . 0.0 104.39 175.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.3 m -126.16 154.96 74.34 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 175.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.75 162.87 36.85 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 CA-C-N 121.357 1.52 . . . . 0.0 109.565 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.5 -158.63 10.43 Favored Glycine 0 CA--C 1.523 0.575 0 C-N-CA 126.517 2.008 . . . . 0.0 108.69 175.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -60.23 167.59 2.35 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 122.073 0.939 . . . . 0.0 112.694 176.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -138.0 161.64 36.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.752 2.021 . . . . 0.0 110.271 -175.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.42 176.74 43.93 Favored Glycine 0 CA--C 1.527 0.785 0 CA-C-O 122.029 0.794 . . . . 0.0 113.346 178.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -125.77 -3.46 7.15 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.494 1.918 . . . . 0.0 112.042 -176.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.421 ' HG3' ' HD1' ' A' ' 50' ' ' HIS . 2.7 tp10 -131.22 127.78 38.6 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 127.27 2.228 . . . . 0.0 105.889 -175.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -83.17 -15.85 48.97 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 118.357 -0.83 . . . . 0.0 109.407 -175.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -55.82 -36.31 67.34 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 120.139 1.336 . . . . 0.0 109.595 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.421 ' HD1' ' HG3' ' A' ' 47' ' ' GLU . 64.4 m80 -65.63 -29.27 69.82 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 118.406 -0.806 . . . . 0.0 112.015 176.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -61.27 -51.67 67.93 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 124.42 1.088 . . . . 0.0 108.936 178.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.8 mp -62.75 -34.7 67.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 O-C-N 121.665 -0.647 . . . . 0.0 109.648 -175.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -73.92 -35.0 64.56 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.131 0.878 . . . . 0.0 111.226 176.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -61.93 -33.42 74.23 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.939 1.296 . . . . 0.0 112.893 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 89.9 m -50.64 121.49 5.89 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.077 0.951 . . . . 0.0 110.337 -176.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.674 ' HG1' ' CG2' ' A' ' 59' ' ' VAL . 2.0 p -84.15 170.69 13.55 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 128.532 2.733 . . . . 0.0 111.798 -176.03 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.484 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 10.2 p-10 -69.9 -76.87 0.09 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.942 2.097 . . . . 0.0 115.957 -174.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.484 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 3.2 t70 -106.51 -30.57 8.98 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 127.106 2.162 . . . . 0.0 112.402 -176.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.674 ' CG2' ' HG1' ' A' ' 56' ' ' THR . 1.5 m -55.18 156.24 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-O 122.966 1.365 . . . . 0.0 111.451 -175.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.0 123.81 48.72 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 176.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.5 tp -129.29 165.98 20.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.628 1.571 . . . . 0.0 109.317 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -132.01 152.25 51.25 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -138.01 155.05 49.24 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.009 1.324 . . . . 0.0 111.268 177.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -127.9 123.49 35.12 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.956 -2.239 . . . . 0.0 104.956 177.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.1 t -132.5 135.77 57.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -80.48 123.69 28.28 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 175.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -126.25 169.88 12.43 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.929 1.292 . . . . 0.0 108.029 -176.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -136.05 113.36 10.66 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 120.162 -1.586 . . . . 0.0 108.683 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.8 m -156.38 151.6 26.51 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.75 1.62 . . . . 0.0 106.633 175.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 113.06 113.27 3.17 Favored Glycine 0 N--CA 1.441 -0.995 0 N-CA-C 103.296 -3.922 . . . . 0.0 103.296 -175.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -89.97 113.88 25.61 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 111.942 -2.129 . . . . 0.0 106.449 -175.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.57 176.72 9.61 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.248 1.019 . . . . 0.0 110.363 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 69.4 mtm -66.35 -5.77 11.9 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.574 1.55 . . . . 0.0 113.397 176.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.3 m -146.33 170.64 16.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 119.998 -1.689 . . . . 0.0 108.795 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -61.56 151.41 33.23 Favored 'General case' 0 C--N 1.339 0.136 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 177.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -137.47 161.97 34.92 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 103.796 -2.668 . . . . 0.0 103.796 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.1 t -142.05 149.14 39.55 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 176.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -131.15 172.38 12.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -141.69 139.67 33.0 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 177.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -116.47 117.58 30.3 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -176.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -91.47 113.64 25.96 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 102.138 -3.282 . . . . 0.0 102.138 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.3 mp -105.75 125.73 61.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -101.84 123.51 45.9 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 56.0 t-105 -95.33 123.41 38.84 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 104.729 -2.323 . . . . 0.0 104.729 175.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.3 mt -143.92 98.36 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 -179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -63.32 166.79 24.69 Favored Glycine 0 CA--C 1.534 1.226 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 175.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -77.97 -12.01 59.95 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.344 -1.68 . . . . 0.0 110.628 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -83.07 -27.43 30.27 Favored 'General case' 0 C--O 1.237 0.426 0 O-C-N 120.14 -1.6 . . . . 0.0 112.17 -175.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.3 p -67.43 123.85 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 104.75 -2.315 . . . . 0.0 104.75 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.7 t -66.23 158.73 28.13 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 122.203 1.001 . . . . 0.0 111.4 -175.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.92 -24.43 49.81 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.411 1.482 . . . . 0.0 113.196 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 9.8 tt -67.99 -50.79 53.5 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-N 119.354 1.577 . . . . 0.0 109.641 176.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -63.96 -43.65 95.16 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 176.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 42.3 ttp85 -55.09 -35.81 64.98 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 118.391 0.541 . . . . 0.0 111.249 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.63 -26.62 65.63 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 118.025 -0.988 . . . . 0.0 111.888 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -57.15 -39.47 75.27 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 121.115 1.78 . . . . 0.0 111.371 175.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 38.1 m -55.5 -28.22 53.31 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 119.948 1.249 . . . . 0.0 110.99 175.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.44 -20.58 67.84 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.409 1.481 . . . . 0.0 114.406 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 92.4 m -120.9 -6.96 9.55 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.909 1.284 . . . . 0.0 110.89 176.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -104.19 -24.96 13.1 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-O 118.247 -0.882 . . . . 0.0 113.169 -175.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -58.63 -24.04 60.28 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 121.248 1.84 . . . . 0.0 111.434 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -69.65 -41.25 75.82 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 120.197 1.362 . . . . 0.0 108.608 175.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 25.4 mt -57.5 -63.04 1.37 Allowed 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 126.193 1.797 . . . . 0.0 111.408 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.53 -29.65 42.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.059 176.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -72.14 -25.06 61.56 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-O 116.882 -1.532 . . . . 0.0 111.714 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -61.64 -38.53 88.03 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 122.061 2.209 . . . . 0.0 109.713 175.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 98.9 t -72.97 -60.37 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 175.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 39.3 t -77.79 26.45 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 129.153 2.981 . . . . 0.0 112.927 -175.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -57.19 -26.36 60.51 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 119.713 -1.867 . . . . 0.0 110.751 -177.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -84.3 72.49 10.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.92 1.288 . . . . 0.0 107.854 175.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -145.03 174.63 10.87 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 122.826 0.45 . . . . 0.0 110.878 176.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.35 -66.2 0.93 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 118.507 -0.759 . . . . 0.0 109.865 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.38 176.41 11.71 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.702 2.001 . . . . 0.0 108.721 178.095 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -106.4 173.5 6.29 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 123.568 0.747 . . . . 0.0 112.204 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -143.4 155.04 44.29 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 103.126 -2.916 . . . . 0.0 103.126 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 14.7 t -131.84 129.52 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 O-C-N 120.61 -1.306 . . . . 0.0 107.679 175.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -133.97 148.1 30.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 125.509 1.524 . . . . 0.0 107.835 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 7.7 p -130.85 -8.45 3.97 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.454 1.902 . . . . 0.0 113.966 -176.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -124.22 124.27 42.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -176.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.9 ttp85 -60.17 -30.56 69.41 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.316 -178.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -74.66 -26.18 59.69 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 119.83 1.195 . . . . 0.0 111.909 175.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.31 -40.54 43.95 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -177.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -45.18 -23.32 0.16 Allowed 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 130.195 3.398 . . . . 0.0 116.279 -175.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -48.15 130.54 15.88 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 125.476 1.51 . . . . 0.0 111.782 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -56.12 -16.48 5.19 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 176.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.262 30.2 t70 -58.1 -56.42 22.31 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 117.565 -1.207 . . . . 0.0 112.988 -175.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -77.09 -26.36 53.32 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 116.459 -2.096 . . . . 0.0 107.608 -175.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 51.4 mt -55.72 -40.84 62.77 Favored 'Isoleucine or valine' 0 C--N 1.343 0.302 0 C-N-CA 124.836 1.254 . . . . 0.0 108.331 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.2 mtmm -54.35 -52.17 62.43 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.915 0.779 . . . . 0.0 110.438 175.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 47.5 t -63.93 -44.25 93.43 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 117.962 -1.018 . . . . 0.0 109.47 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -63.85 -40.54 96.82 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.731 1.605 . . . . 0.0 110.687 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.44 -32.68 74.42 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.754 0.821 . . . . 0.0 109.358 175.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 46.3 mmtt -76.31 -38.53 55.9 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.412 1.485 . . . . 0.0 112.083 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -59.86 -57.24 13.73 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 125.998 1.719 . . . . 0.0 106.79 175.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.73 -3.38 21.62 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.461 0.705 . . . . 0.0 112.582 175.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -93.19 -54.85 1.66 Allowed Glycine 0 C--N 1.333 0.371 0 C-N-CA 125.056 1.312 . . . . 0.0 111.121 -176.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 65.82 178.1 7.76 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 122.16 0.867 . . . . 0.0 111.212 -175.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -153.06 85.83 1.23 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -144.38 121.44 11.42 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -136.31 84.56 2.08 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 104.5 -2.407 . . . . 0.0 104.5 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -156.0 136.32 13.07 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 127.592 2.357 . . . . 0.0 107.354 -175.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.03 93.25 1.42 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.985 1.314 . . . . 0.0 108.582 176.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -93.51 62.47 3.34 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.446 -0.784 . . . . 0.0 109.615 -176.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 84.5 56.14 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 127.52 2.328 . . . . 0.0 106.012 -175.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.224 1.81 . . . . 0.0 107.912 -175.735 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.912 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 29.1 mt -131.72 155.76 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 168.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -122.72 109.18 13.92 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 103.62 -2.733 . . . . 0.0 103.62 175.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.55 176.18 5.24 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.062 0.945 . . . . 0.0 110.043 -175.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -75.79 52.25 0.67 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.665 1.586 . . . . 0.0 111.533 177.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.8 m -111.9 171.92 7.21 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 128.06 2.544 . . . . 0.0 106.298 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.7 mmtp -140.48 178.99 6.92 Favored 'General case' 0 CA--C 1.513 -0.446 0 O-C-N 121.219 -0.926 . . . . 0.0 111.332 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -126.23 150.49 31.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 124.58 1.152 . . . . 0.0 109.441 179.243 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -95.05 83.42 3.93 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 101.759 -3.423 . . . . 0.0 101.759 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -61.99 -29.36 70.2 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 117.324 -1.322 . . . . 0.0 112.93 -175.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -69.09 -59.22 3.18 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.629 1.104 . . . . 0.0 108.346 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.62 95.68 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 122.667 0.387 . . . . 0.0 111.276 -176.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 85.7 m -73.97 -33.21 63.79 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.56 -0.733 . . . . 0.0 110.781 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.7 ttt-85 -63.92 -37.1 86.17 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 116.979 -1.486 . . . . 0.0 108.53 175.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.75 -46.91 87.71 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 120.351 1.432 . . . . 0.0 110.679 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.26 -50.78 71.67 Favored 'General case' 0 N--CA 1.462 0.137 0 O-C-N 121.553 -0.717 . . . . 0.0 111.523 176.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -51.39 -47.53 62.87 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.581 0.752 . . . . 0.0 110.293 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.89 -49.55 77.24 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.417 1.887 . . . . 0.0 111.0 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mp -59.52 -51.14 71.14 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 120.275 1.398 . . . . 0.0 111.205 175.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.93 -30.4 47.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 O-C-N 121.741 -0.599 . . . . 0.0 110.033 -178.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.15 -38.74 60.87 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.375 1.07 . . . . 0.0 112.973 175.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -67.46 123.36 20.18 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -175.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.67 -32.16 68.85 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 124.666 1.186 . . . . 0.0 112.205 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.0 -11.47 82.51 Favored Glycine 0 CA--C 1.526 0.757 0 CA-C-O 119.374 -0.681 . . . . 0.0 112.45 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.0 t -81.19 123.62 28.6 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 118.961 1.381 . . . . 0.0 107.552 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.48 -23.89 62.77 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.608 175.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 t -67.23 123.69 20.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -108.32 -23.78 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 C-N-CA 124.315 1.046 . . . . 0.0 110.06 178.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -131.05 138.99 49.86 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.802 0.841 . . . . 0.0 110.502 -179.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 62.0 t -136.34 149.96 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.432 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 23.3 p -104.34 159.76 15.45 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 176.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -124.45 123.82 40.97 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 175.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -98.45 175.78 5.91 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 176.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -127.03 124.05 38.45 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 106.781 -1.562 . . . . 0.0 106.781 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -112.69 123.42 50.27 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 104.261 -2.496 . . . . 0.0 104.261 175.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 23.04 -88.86 0.01 OUTLIER Glycine 0 CA--C 1.529 0.961 0 C-N-CA 127.661 2.553 . . . . 0.0 116.683 -176.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 65.0 p -92.66 2.22 56.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.059 2.143 . . . . 0.0 116.175 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -150.63 175.83 11.57 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.233 1.379 . . . . 0.0 114.647 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 11.6 mm -93.69 136.26 25.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 128.036 2.534 . . . . 0.0 106.256 175.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.8 m -135.31 159.36 72.09 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-O 118.475 -0.774 . . . . 0.0 110.561 176.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.12 155.46 47.24 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 121.753 1.635 . . . . 0.0 110.288 175.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -120.45 -152.86 9.0 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 126.668 2.08 . . . . 0.0 109.728 176.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.42 164.97 5.11 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.491 1.117 . . . . 0.0 110.736 176.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -145.03 162.29 37.31 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.252 1.421 . . . . 0.0 110.127 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.72 176.7 42.91 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-O 122.055 0.809 . . . . 0.0 112.512 -179.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -125.46 -6.07 7.04 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.049 1.739 . . . . 0.0 111.965 -176.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.23 141.9 43.99 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 -177.17 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -83.89 -14.52 50.87 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -174.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -60.56 -36.11 77.68 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 119.885 -1.76 . . . . 0.0 109.564 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -71.7 -22.76 61.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.323 1.049 . . . . 0.0 112.034 175.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -67.09 -43.57 82.2 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.339 1.056 . . . . 0.0 109.522 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.0 mm -54.32 -47.24 69.3 Favored 'Isoleucine or valine' 0 C--N 1.342 0.245 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -176.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.3 mm-40 -65.03 -23.93 67.34 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.53 0.732 . . . . 0.0 112.502 -176.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -77.39 -24.26 50.56 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 119.444 1.02 . . . . 0.0 111.359 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.2 m -73.83 113.62 11.19 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.07 -1.455 . . . . 0.0 107.07 177.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.31 2.1 p -100.73 178.39 4.72 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.892 1.277 . . . . 0.0 110.594 -176.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.09 -76.15 0.1 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 117.951 2.574 . . . . 0.0 117.951 -174.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.39 -27.8 19.09 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 120.226 1.375 . . . . 0.0 114.569 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.7 m -70.63 169.66 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 120.895 -1.128 . . . . 0.0 112.165 -175.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.3 144.77 48.45 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.805 1.242 . . . . 0.0 107.986 178.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.9 tp -146.79 166.63 26.06 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.058 1.743 . . . . 0.0 107.702 -176.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -133.08 157.82 44.31 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 176.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.432 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.71 153.51 41.06 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 118.744 0.702 . . . . 0.0 111.139 175.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -119.86 123.64 44.12 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 104.536 -2.394 . . . . 0.0 104.536 175.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 39.3 t -135.15 138.72 48.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 O-C-N 123.222 0.326 . . . . 0.0 110.209 -175.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.7 ttm180 -75.41 117.85 17.65 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.639 1.976 . . . . 0.0 106.949 175.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -131.88 150.92 52.01 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 84.7 m -111.69 113.3 25.59 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 121.517 -0.74 . . . . 0.0 111.153 -175.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.8 m -156.69 130.69 8.43 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 175.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.34 151.14 5.64 Favored Glycine 0 CA--C 1.519 0.307 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 176.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -124.4 124.57 42.63 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 -175.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.8 179.56 7.49 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.504 1.922 . . . . 0.0 107.161 175.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 60.8 mtm -65.97 -6.84 13.92 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.501 0.591 . . . . 0.0 111.713 175.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.2 m -146.0 176.43 9.71 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.955 2.102 . . . . 0.0 109.845 -175.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -55.78 143.35 31.34 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.379 0.671 . . . . 0.0 109.585 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -119.38 162.46 18.76 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 t -139.55 151.73 46.32 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.3 mttp -146.39 175.81 10.26 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.686 1.995 . . . . 0.0 107.076 176.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -140.26 134.69 31.4 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 175.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -104.83 114.26 28.36 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 124.877 1.361 . . . . 0.0 107.401 177.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -83.47 113.53 20.84 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 102.339 -3.208 . . . . 0.0 102.339 175.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 mt -96.75 142.66 13.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 -176.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.3 m -125.59 123.46 39.08 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 104.382 -2.451 . . . . 0.0 104.382 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 39.5 t-105 -103.06 124.28 48.24 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 104.825 -2.287 . . . . 0.0 104.825 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 mm -125.54 110.06 23.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 103.562 -2.755 . . . . 0.0 103.562 175.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -54.96 126.8 39.54 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 107.643 -2.183 . . . . 0.0 107.643 175.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.53 -12.25 2.58 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 118.786 1.293 . . . . 0.0 112.833 -175.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -83.77 -30.68 26.43 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 117.324 -1.322 . . . . 0.0 111.401 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.14 143.82 13.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 121.083 1.765 . . . . 0.0 111.392 -175.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.0 t -143.16 176.69 8.93 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.463 1.905 . . . . 0.0 106.938 175.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 79.58 -156.32 40.65 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 176.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.0 tt -59.27 -42.52 91.41 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.404 1.081 . . . . 0.0 112.535 -175.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -33.62 73.86 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 120.706 1.594 . . . . 0.0 111.536 -176.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.31 -50.33 27.83 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 175.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.34 -27.02 67.03 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 125.17 1.388 . . . . 0.0 113.41 -176.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -46.26 -41.32 12.85 Favored 'General case' 0 CA--C 1.502 -0.889 0 C-N-CA 124.489 1.116 . . . . 0.0 110.205 175.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.2 m -52.79 -39.6 62.47 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.422 1.089 . . . . 0.0 111.144 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -74.86 -10.31 83.59 Favored Glycine 0 CA--C 1.532 1.146 0 O-C-N 121.351 -0.843 . . . . 0.0 113.612 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 47.2 m -112.46 -15.14 13.15 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.358 1.863 . . . . 0.0 110.763 177.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -104.31 -29.33 10.85 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 126.504 1.921 . . . . 0.0 112.898 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -54.41 -33.04 58.59 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 119.901 1.228 . . . . 0.0 112.885 177.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.8 t -63.95 -34.19 77.43 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 118.842 0.746 . . . . 0.0 111.412 176.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 30.8 mt -67.76 -61.82 1.7 Allowed 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 125.678 1.591 . . . . 0.0 109.478 -175.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -58.67 -33.33 48.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-O 118.147 -0.93 . . . . 0.0 109.173 175.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 63.0 tttt -64.92 -42.07 95.03 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 120.481 1.491 . . . . 0.0 110.232 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.78 -26.06 61.4 Favored 'General case' 0 C--N 1.335 -0.048 0 CA-C-N 119.146 0.885 . . . . 0.0 111.952 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 69.7 t -84.27 -61.74 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 175.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.05 26.53 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 129.843 3.257 . . . . 0.0 113.448 -175.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -50.54 -26.78 5.61 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 119.895 -1.753 . . . . 0.0 112.491 -176.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -88.75 74.49 8.33 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 175.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -140.04 161.0 38.66 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 175.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -87.49 -66.83 0.87 Allowed 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.201 -176.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.99 176.34 12.32 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 129.615 3.166 . . . . 0.0 108.698 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -119.89 165.73 14.24 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.345 1.058 . . . . 0.0 112.74 -175.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -133.94 147.31 51.05 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 104.311 -2.478 . . . . 0.0 104.311 -175.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.8 t -123.14 129.52 74.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 176.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -132.9 141.14 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 125.26 1.424 . . . . 0.0 107.752 -176.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 p -139.38 -2.26 1.63 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 175.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -129.07 151.35 49.85 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 124.512 1.125 . . . . 0.0 110.182 178.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 40.8 ttp-105 -58.19 -45.43 87.59 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 123.103 0.561 . . . . 0.0 110.881 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -65.66 -23.48 66.8 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.65 0.659 . . . . 0.0 110.539 -176.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -83.37 -23.25 32.53 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.9 2.08 . . . . 0.0 110.986 175.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -77.35 -23.29 50.9 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.692 1.597 . . . . 0.0 112.536 178.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 -63.4 123.78 19.59 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -175.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -49.69 -25.25 2.77 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 119.28 3.067 . . . . 0.0 119.28 175.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -63.33 -56.26 17.83 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 119.335 0.971 . . . . 0.0 113.154 -175.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -78.37 -26.09 46.52 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 118.0 -1.48 . . . . 0.0 109.152 -177.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 19.4 mt -52.7 -40.5 34.81 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 C-N-CA 124.899 1.28 . . . . 0.0 108.926 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 33.8 mttp -54.8 -49.49 70.84 Favored 'General case' 0 N--CA 1.457 -0.075 0 CA-C-N 118.213 0.46 . . . . 0.0 111.766 176.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 35.1 t -72.0 -36.31 69.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.059 0.544 . . . . 0.0 111.379 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.15 -46.03 91.05 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 119.466 1.03 . . . . 0.0 108.603 176.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 74.1 mt -66.6 -23.92 66.25 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 123.849 0.86 . . . . 0.0 110.883 175.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 16.1 mttt -73.0 -47.81 41.88 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 120.413 1.461 . . . . 0.0 107.182 175.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -61.44 -60.78 3.19 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.716 0.806 . . . . 0.0 109.036 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.37 1.22 1.71 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.087 1.355 . . . . 0.0 112.124 175.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -38.76 106.5 0.05 OUTLIER Glycine 0 C--N 1.337 0.619 0 C-N-CA 128.368 2.89 . . . . 0.0 111.962 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -66.26 102.46 0.73 Allowed Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 106.668 -2.573 . . . . 0.0 106.668 175.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.03 144.68 18.63 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 -179.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -144.25 122.82 12.48 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -176.093 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -134.66 97.08 3.69 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 105.253 -2.128 . . . . 0.0 105.253 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -146.67 88.48 1.77 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.472 -1.24 . . . . 0.0 107.825 -175.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -101.05 95.13 6.37 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.741 1.216 . . . . 0.0 110.202 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -149.12 77.33 1.36 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.006 1.323 . . . . 0.0 108.456 175.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 4.8 m 60.53 56.03 3.22 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.547 1.139 . . . . 0.0 109.662 -178.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 125.825 1.65 . . . . 0.0 109.855 178.434 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.761 0 N-CA-C 110.466 -1.054 . . . . 0.0 110.466 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.4 tt -74.3 33.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 C-N-CA 124.793 1.237 . . . . 0.0 112.546 -174.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 67.7 mtt85 -135.93 119.1 16.56 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 127.397 2.279 . . . . 0.0 106.518 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 91.4 mtp -77.49 23.56 0.22 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.439 1.095 . . . . 0.0 111.186 176.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.75 62.64 7.51 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 125.598 1.559 . . . . 0.0 108.028 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.9 m -142.99 158.27 43.76 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.608 1.563 . . . . 0.0 106.962 -175.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -132.66 -171.73 2.73 Favored 'General case' 0 CA--C 1.518 -0.282 0 O-C-N 121.273 -0.892 . . . . 0.0 111.92 -175.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.9 152.9 33.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 C-N-CA 124.388 1.075 . . . . 0.0 110.913 176.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -99.78 85.0 3.0 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 100.601 -3.851 . . . . 0.0 100.601 174.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -61.24 -24.3 66.27 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 117.166 -1.397 . . . . 0.0 112.54 -175.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -76.95 -54.18 6.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 120.786 1.63 . . . . 0.0 109.205 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.11 -36.33 83.23 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.768 -0.583 . . . . 0.0 111.043 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 79.5 m -75.56 -38.84 58.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 118.966 -0.54 . . . . 0.0 111.526 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.7 ttt-85 -60.06 -34.53 73.55 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-O 116.789 -1.577 . . . . 0.0 109.024 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.87 -56.6 18.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 120.596 1.544 . . . . 0.0 110.509 -177.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.42 -43.69 98.44 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 118.507 0.594 . . . . 0.0 111.751 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -55.24 -44.19 75.27 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -59.51 -41.95 91.11 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.327 1.451 . . . . 0.0 111.105 -176.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.37 -60.99 2.77 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 123.984 0.802 . . . . 0.0 109.88 175.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.06 -31.64 46.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 122.978 0.511 . . . . 0.0 111.58 -175.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -37.25 86.92 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 125.872 1.669 . . . . 0.0 110.769 176.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -81.59 123.21 28.48 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 124.013 0.821 . . . . 0.0 109.68 -176.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.13 -17.87 64.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 118.596 -0.716 . . . . 0.0 112.884 175.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.28 -12.44 80.67 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.737 1.16 . . . . 0.0 113.061 176.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.1 t -80.06 137.9 36.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 119.559 1.68 . . . . 0.0 109.038 -177.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -74.34 -18.59 60.67 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.233 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.0 t -82.45 123.83 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 106.495 -1.668 . . . . 0.0 106.495 176.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -113.64 -23.65 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.66 -178.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 26.5 p-90 -129.48 135.49 48.7 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.636 0.774 . . . . 0.0 109.19 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 33.4 t -136.03 166.34 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 175.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 65.1 p -123.55 161.67 24.48 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.946 0.898 . . . . 0.0 109.757 175.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -128.18 123.7 34.98 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 175.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -95.21 176.16 6.33 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 178.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -122.53 140.35 52.87 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -142.12 143.46 33.03 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.728 1.611 . . . . 0.0 107.219 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 36.62 -104.69 0.03 OUTLIER Glycine 0 CA--C 1.528 0.857 0 C-N-CA 126.281 1.896 . . . . 0.0 113.55 -177.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.7 p -125.08 33.53 5.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.629 1.572 . . . . 0.0 111.224 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.2 t -142.78 175.85 9.51 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 122.022 0.915 . . . . 0.0 111.812 176.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.5 mm -102.92 137.96 29.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 126.035 1.734 . . . . 0.0 106.432 177.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.13 165.28 33.4 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 123.78 0.832 . . . . 0.0 109.583 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.78 168.33 24.86 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 121.842 1.695 . . . . 0.0 111.607 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.24 -170.74 12.08 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 126.495 1.998 . . . . 0.0 109.472 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -61.33 161.8 8.65 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.105 1.362 . . . . 0.0 111.215 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -145.13 174.11 11.34 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.06 1.344 . . . . 0.0 111.336 -178.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.39 -175.92 42.35 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 124.074 0.845 . . . . 0.0 111.568 177.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.96 -26.61 6.82 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 125.941 1.696 . . . . 0.0 110.134 175.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -108.15 130.47 55.12 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -82.96 -10.3 58.86 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -174.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 42.1 tt0 -54.09 -39.34 66.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 120.746 1.612 . . . . 0.0 111.156 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -56.93 -38.6 73.11 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.929 1.292 . . . . 0.0 111.769 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -59.0 -37.62 77.3 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.743 1.217 . . . . 0.0 108.525 -177.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.8 mm -61.96 -49.76 82.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -175.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -66.72 -32.42 73.71 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.52 0.6 . . . . 0.0 111.817 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -60.83 -38.89 87.01 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-O 118.786 -0.626 . . . . 0.0 111.192 -176.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.3 m -57.75 118.68 5.54 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.049 0.94 . . . . 0.0 110.442 -176.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 p -83.92 -173.9 4.98 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 129.28 3.032 . . . . 0.0 111.943 -176.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.405 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 19.9 p-10 -78.34 -70.29 0.5 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.112 0.965 . . . . 0.0 111.553 176.171 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.405 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 10.1 t70 -106.24 -36.34 6.9 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.378 1.871 . . . . 0.0 113.807 -175.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.5 m -60.41 129.86 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -175.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.82 141.95 35.23 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.289 1.835 . . . . 0.0 106.19 -175.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 tp -142.5 169.36 17.71 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.56 1.144 . . . . 0.0 110.892 -174.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -124.43 143.57 50.55 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.437 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -128.0 147.72 50.51 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 125.723 1.609 . . . . 0.0 110.331 176.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -121.31 124.06 43.67 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 104.394 -2.447 . . . . 0.0 104.394 177.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.5 t -136.8 143.6 34.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 O-C-N 123.358 0.411 . . . . 0.0 110.804 -175.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.3 119.04 25.23 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.315 1.446 . . . . 0.0 107.517 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -136.39 126.93 26.92 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.451 1.1 . . . . 0.0 109.048 -176.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.5 m -74.13 113.74 11.66 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 124.591 1.157 . . . . 0.0 110.169 -175.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 m -145.33 157.27 44.08 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 119.429 1.013 . . . . 0.0 111.025 176.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.7 125.59 2.83 Favored Glycine 0 C--N 1.333 0.403 0 C-N-CA 126.958 2.218 . . . . 0.0 110.341 176.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -83.56 122.8 29.05 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 126.596 1.958 . . . . 0.0 107.931 -175.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.62 172.36 13.71 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 125.778 1.631 . . . . 0.0 107.073 175.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -79.77 -6.9 58.18 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.04 0.536 . . . . 0.0 110.324 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.5 m -114.64 170.61 8.19 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 127.447 2.299 . . . . 0.0 110.442 -175.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -71.34 149.29 46.22 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 105.353 -2.092 . . . . 0.0 105.353 175.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -133.63 154.56 50.81 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 175.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.2 t -145.09 128.76 17.17 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -135.3 175.7 9.34 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -138.89 141.21 38.57 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.291 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -115.87 134.18 55.26 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 125.899 1.68 . . . . 0.0 107.438 -178.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -102.92 113.57 27.12 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 175.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mp -107.13 138.73 31.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 -175.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.3 m -121.32 123.47 42.24 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 104.766 -2.309 . . . . 0.0 104.766 -177.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -93.02 123.35 36.21 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 176.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.9 mm -145.45 85.46 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.25 153.91 16.64 Favored Glycine 0 CA--C 1.532 1.136 0 O-C-N 121.551 -0.718 . . . . 0.0 112.205 -175.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -61.57 -19.44 62.17 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.565 -1.55 . . . . 0.0 112.132 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -83.36 -13.59 54.65 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 121.103 -0.998 . . . . 0.0 111.715 -176.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 12.7 p -72.64 131.93 34.12 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-N 120.001 1.273 . . . . 0.0 110.007 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.8 t -60.14 149.46 32.66 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.95 0.9 . . . . 0.0 109.367 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.53 -26.5 59.75 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.2 tt -68.89 -51.11 43.59 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 119.201 1.5 . . . . 0.0 110.668 177.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 19.9 mp0 -60.99 -38.82 87.35 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.315 -0.866 . . . . 0.0 109.5 175.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -61.62 -32.5 72.64 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.753 0.821 . . . . 0.0 111.248 175.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.79 -23.87 67.38 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.394 177.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.46 -54.05 50.24 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.913 1.688 . . . . 0.0 107.885 175.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 58.6 m -51.99 -38.22 55.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.864 0.866 . . . . 0.0 108.892 175.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -57.89 -19.87 38.67 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.067 1.318 . . . . 0.0 115.413 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 10.8 m -119.15 -2.94 10.64 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.816 1.808 . . . . 0.0 111.283 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -103.03 -23.7 13.67 Favored 'General case' 0 CA--C 1.516 -0.334 0 O-C-N 121.107 -0.995 . . . . 0.0 112.897 -175.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -49.77 -39.23 37.26 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.495 1.498 . . . . 0.0 112.604 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.8 t -59.87 -30.48 69.02 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.368 0.531 . . . . 0.0 111.753 -179.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.4 mt -64.47 -63.36 1.15 Allowed 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 124.562 1.145 . . . . 0.0 109.014 -178.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.251 0.9 OUTLIER -59.29 -29.38 41.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 118.603 -0.713 . . . . 0.0 109.655 175.83 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -63.32 -47.25 83.01 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 120.104 1.32 . . . . 0.0 109.017 175.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -52.42 -30.67 30.56 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.103 1.361 . . . . 0.0 111.92 -178.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 91.9 t -84.02 -54.41 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.054 0.942 . . . . 0.0 109.682 176.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 47.6 t -86.32 26.12 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 127.39 2.276 . . . . 0.0 114.081 -175.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -53.1 -26.55 16.78 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 119.749 -1.844 . . . . 0.0 114.752 -175.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -91.4 83.52 5.45 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -145.65 175.4 10.4 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 126.135 1.774 . . . . 0.0 107.759 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -101.95 -66.21 0.94 Allowed 'General case' 0 C--O 1.234 0.275 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -175.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -144.35 172.52 12.82 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 125.043 1.337 . . . . 0.0 109.598 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -126.59 168.37 14.4 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.159 0.984 . . . . 0.0 110.647 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -148.44 157.59 43.57 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 105.302 -2.11 . . . . 0.0 105.302 -175.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.4 t -131.8 124.19 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -123.92 141.53 43.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -179.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.3 p -129.26 3.2 5.17 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.517 1.127 . . . . 0.0 113.726 -176.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -137.73 124.56 21.2 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.693 1.197 . . . . 0.0 108.363 -175.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -64.56 -25.02 67.8 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.842 0.857 . . . . 0.0 112.189 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 32.6 mtmt -74.24 -47.32 35.98 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 119.973 1.261 . . . . 0.0 108.438 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -59.84 -39.17 84.22 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.622 -0.704 . . . . 0.0 111.662 178.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -44.04 -23.19 0.08 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 130.768 3.627 . . . . 0.0 115.554 -175.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -46.42 135.79 7.94 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 126.095 1.758 . . . . 0.0 109.68 175.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -63.87 -14.06 50.21 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 121.569 -0.707 . . . . 0.0 112.653 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -57.8 -55.32 36.44 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 119.168 0.895 . . . . 0.0 110.446 -176.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.33 -26.68 60.3 Favored 'General case' 0 C--N 1.351 0.657 0 C-N-CA 115.488 -2.485 . . . . 0.0 109.383 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 69.4 mt -60.41 -46.02 95.81 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -56.79 -52.69 64.05 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.31 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 34.1 t -61.85 -41.81 98.27 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.737 0.698 . . . . 0.0 110.335 -177.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -62.95 -51.31 67.38 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 123.668 0.787 . . . . 0.0 109.749 177.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 98.0 mt -63.7 -31.5 72.69 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.289 -1.507 . . . . 0.0 111.628 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -47.98 75.66 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.515 1.526 . . . . 0.0 107.953 175.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 46.9 mttm -62.02 -41.59 98.25 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.821 0.848 . . . . 0.0 109.234 175.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.27 -25.42 66.86 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.818 1.647 . . . . 0.0 112.98 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 24.09 -94.14 0.01 OUTLIER Glycine 0 C--N 1.343 0.967 0 C-N-CA 128.53 2.967 . . . . 0.0 112.753 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 98.94 175.04 31.99 Favored Glycine 0 CA--C 1.521 0.445 0 C-N-CA 125.682 1.611 . . . . 0.0 112.779 175.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -103.93 108.53 19.9 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.28 1.032 . . . . 0.0 110.017 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 -156.1 100.77 2.04 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.406 1.082 . . . . 0.0 108.127 175.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -92.44 85.57 5.39 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -133.44 113.45 12.53 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 131.484 3.914 . . . . 0.0 104.914 -176.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.04 136.65 13.29 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.802 2.041 . . . . 0.0 106.438 178.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -141.96 152.92 43.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 175.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 76.38 56.04 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 -175.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.256 1.441 0 C-N-CA 126.756 2.022 . . . . 0.0 106.356 176.923 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.659 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.0 mt -81.08 77.11 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 177.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -155.51 23.79 0.4 Allowed 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.614 -1.304 . . . . 0.0 110.619 -177.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.24 174.74 5.84 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.997 0.919 . . . . 0.0 111.402 -175.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -138.35 68.57 1.39 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 126.437 1.895 . . . . 0.0 107.349 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m -135.81 168.89 18.46 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 175.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -133.86 -178.31 4.96 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.556 -1.34 . . . . 0.0 112.662 -178.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.24 151.37 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 124.498 1.119 . . . . 0.0 108.933 178.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -93.61 77.41 4.34 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 101.881 -3.377 . . . . 0.0 101.881 174.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.77 -24.45 65.77 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.966 -1.016 . . . . 0.0 112.85 -175.161 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -70.24 -56.48 6.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 119.641 1.11 . . . . 0.0 109.128 -175.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.52 86.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.56 0.344 . . . . 0.0 110.488 176.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.1 m -64.99 -36.09 83.28 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.727 -0.608 . . . . 0.0 111.501 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -61.24 -35.0 76.04 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 117.461 -1.257 . . . . 0.0 110.092 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.55 -53.21 59.35 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 120.248 1.385 . . . . 0.0 110.541 -178.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.63 -41.02 96.44 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.752 0.706 . . . . 0.0 111.261 178.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -56.79 -39.08 73.46 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.268 1.027 . . . . 0.0 110.057 177.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -66.67 -46.32 76.05 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 126.141 1.776 . . . . 0.0 110.785 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.5 mp -58.62 -52.76 64.3 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 118.784 0.72 . . . . 0.0 112.001 175.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 31.5 t -63.52 -36.51 76.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 118.777 0.717 . . . . 0.0 110.603 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.4 ttm-85 -63.7 -37.52 87.66 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 118.817 -0.611 . . . . 0.0 110.308 175.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -75.44 141.09 43.23 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.28 1.032 . . . . 0.0 113.189 -175.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -86.33 -11.85 50.99 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 126.448 1.899 . . . . 0.0 112.87 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -88.14 -35.8 8.67 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.0 t -54.39 138.45 39.69 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.892 1.677 . . . . 0.0 108.74 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.6 -35.52 60.52 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 175.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.8 t -63.08 127.22 22.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 C-N-CA 125.971 1.709 . . . . 0.0 109.99 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.5 pp -114.96 -23.83 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 126.489 1.916 . . . . 0.0 111.874 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 42.6 p-90 -126.27 148.86 49.42 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 119.577 1.08 . . . . 0.0 109.015 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.4 t -140.02 161.35 26.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 127.356 2.262 . . . . 0.0 106.682 176.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 17.2 p -124.07 156.73 36.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -132.5 124.7 29.02 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -110.32 176.47 5.04 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 -176.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.434 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 36.0 m-85 -123.28 136.5 54.72 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -176.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -148.76 124.03 10.21 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 175.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 54.95 -128.59 43.83 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 p -86.73 9.78 17.84 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.8 t -143.56 171.77 13.71 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 120.228 1.376 . . . . 0.0 114.604 -175.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.434 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 51.0 mm -90.76 137.13 22.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 101.826 -3.398 . . . . 0.0 101.826 174.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.1 m -121.83 158.95 53.17 Favored Pre-proline 0 C--O 1.236 0.376 0 C-N-CA 123.521 0.728 . . . . 0.0 110.132 176.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.19 154.61 61.82 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 121.167 1.245 . . . . 0.0 110.139 175.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.83 -171.31 15.0 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 127.295 2.379 . . . . 0.0 109.213 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -64.67 167.51 7.22 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 122.186 -0.597 . . . . 0.0 110.407 175.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -149.69 162.14 40.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.998 1.319 . . . . 0.0 109.02 -177.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.36 177.37 48.3 Favored Glycine 0 CA--C 1.524 0.615 0 CA-C-N 117.999 0.363 . . . . 0.0 112.227 -176.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.94 -7.23 17.1 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.222 1.409 . . . . 0.0 113.726 -175.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.6 137.93 45.71 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.737 1.215 . . . . 0.0 108.913 -175.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -84.54 -10.84 57.06 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 -175.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -61.45 -42.85 99.4 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 119.85 -1.781 . . . . 0.0 111.894 -176.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 75.4 m80 -68.96 -22.71 64.1 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.016 0.825 . . . . 0.0 111.393 178.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -61.83 -31.43 71.67 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 120.658 -1.277 . . . . 0.0 111.75 177.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.4 mm -62.03 -34.42 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -82.9 -32.64 27.21 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 117.834 -1.079 . . . . 0.0 110.099 175.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -53.82 -42.86 68.87 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 120.007 1.276 . . . . 0.0 111.081 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 76.5 m -60.89 113.42 2.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.3 p -83.62 176.93 8.65 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.466 1.506 . . . . 0.0 110.915 -176.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -72.19 -58.24 3.58 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 117.813 2.523 . . . . 0.0 117.813 -175.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -106.2 -35.51 7.17 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 117.181 2.289 . . . . 0.0 117.181 -174.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.7 m -67.77 173.37 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 123.007 1.384 . . . . 0.0 112.213 -175.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.8 ptt-85 -111.35 135.97 51.14 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 175.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.2 tp -134.48 162.15 33.05 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -131.99 147.23 52.44 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -139.38 126.97 21.75 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.37 0.668 . . . . 0.0 110.665 -178.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -95.65 123.36 39.17 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 101.933 -3.358 . . . . 0.0 101.933 175.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.2 t -135.09 136.17 51.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -175.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.482 ' NH1' ' HG ' ' A' ' 77' ' ' SER . 15.2 ttm-85 -75.71 130.49 38.77 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.86 1.664 . . . . 0.0 106.853 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -136.28 157.92 45.66 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.251 1.02 . . . . 0.0 109.407 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.0 m -116.26 113.43 22.99 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 120.77 -1.206 . . . . 0.0 109.973 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 32.6 m -152.14 157.91 42.2 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.928 1.291 . . . . 0.0 108.403 175.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 96.34 161.93 32.79 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 125.738 1.637 . . . . 0.0 111.124 176.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.24 139.09 39.07 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 124.287 1.035 . . . . 0.0 108.717 -177.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.8 -173.8 4.32 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 129.527 3.131 . . . . 0.0 104.508 175.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 87.5 mtp -68.33 -4.34 14.13 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.592 -1.318 . . . . 0.0 110.083 175.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.7 m -136.44 168.07 20.15 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.403 2.681 . . . . 0.0 109.589 -175.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.5 mmtt -71.13 164.93 24.64 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 175.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.3 mtp180 -131.59 168.62 17.38 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 -177.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.482 ' HG ' ' NH1' ' A' ' 66' ' ' ARG . 6.8 t -145.4 132.93 20.82 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.162 -1.422 . . . . 0.0 107.162 175.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp -123.48 176.08 6.39 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.761 2.024 . . . . 0.0 107.49 -177.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -141.89 143.73 33.46 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 176.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -119.91 133.32 55.61 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 177.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -97.71 113.12 24.81 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 175.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mp -99.38 144.0 12.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -125.32 123.6 39.77 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 104.737 -2.32 . . . . 0.0 104.737 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.1 t-105 -100.68 131.89 46.35 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 175.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.0 mt -136.27 108.92 8.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 175.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.97 134.65 22.33 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 175.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.81 -7.01 9.42 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.179 -1.189 . . . . 0.0 113.112 -175.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -83.65 -23.63 31.72 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 120.188 -1.57 . . . . 0.0 112.96 176.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 14.2 p -85.82 123.02 39.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 120.921 1.691 . . . . 0.0 110.974 -175.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 25.3 t -146.67 124.14 11.7 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 175.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.72 -167.17 27.2 Favored Glycine 0 C--O 1.24 0.494 0 N-CA-C 107.562 -2.215 . . . . 0.0 107.562 -175.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.0 tt -53.68 -39.36 65.07 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 117.915 0.857 . . . . 0.0 109.899 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -57.03 -36.22 70.21 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.389 0.995 . . . . 0.0 111.248 -176.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.25 -49.58 27.0 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.18 -24.04 51.7 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.525 1.13 . . . . 0.0 112.844 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -50.24 -45.01 53.68 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 124.764 1.225 . . . . 0.0 109.384 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.4 m -55.09 -39.13 68.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 118.891 0.769 . . . . 0.0 110.886 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.05 -26.12 74.14 Favored Glycine 0 CA--C 1.526 0.737 0 CA-C-N 119.164 0.893 . . . . 0.0 112.717 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 99.7 m -94.48 -17.92 21.97 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.995 1.718 . . . . 0.0 111.223 177.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -104.25 -23.56 13.22 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 126.201 1.8 . . . . 0.0 115.178 -174.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -52.46 -27.86 17.85 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 120.817 1.644 . . . . 0.0 113.902 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -62.64 -43.78 97.94 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.827 1.194 . . . . 0.0 109.404 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 18.7 mt -55.2 -65.3 0.61 Allowed 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 125.774 1.63 . . . . 0.0 110.758 -175.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.288 0.8 OUTLIER -58.88 -28.67 38.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.564 176.196 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.8 tttm -69.24 -35.37 76.07 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 121.017 1.735 . . . . 0.0 110.312 175.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -57.71 -28.91 64.27 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 120.327 1.421 . . . . 0.0 110.366 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 89.3 t -79.97 -64.44 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 175.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 86.8 t -67.06 25.35 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 130.069 3.348 . . . . 0.0 114.431 -175.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -55.35 -26.6 41.92 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 118.884 -2.385 . . . . 0.0 115.217 -175.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -92.65 83.71 4.92 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 175.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -147.03 166.14 27.74 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.119 0.485 . . . . 0.0 109.702 175.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.72 -66.49 0.92 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.922 1.289 . . . . 0.0 110.04 -175.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -145.97 176.31 9.79 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 127.903 2.481 . . . . 0.0 109.592 175.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -117.14 167.48 11.15 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.693 1.197 . . . . 0.0 110.789 177.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -146.51 148.68 32.46 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -175.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 48.2 t -126.95 127.06 69.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 175.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mp -129.44 142.56 43.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 N-CA-C 106.348 -1.723 . . . . 0.0 106.348 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 p -130.08 -0.75 4.66 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.414 ' OD1' ' HE3' ' A' ' 121' ' ' LYS . 31.4 t0 -118.78 124.14 46.53 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.227 0.921 . . . . 0.0 109.267 176.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -65.63 -24.33 67.02 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.802 0.841 . . . . 0.0 111.189 -176.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.414 ' HE3' ' OD1' ' A' ' 119' ' ' ASP . 24.2 mtmt -76.45 -32.5 58.45 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.087 1.355 . . . . 0.0 110.017 175.206 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.61 -35.17 45.99 Favored 'General case' 0 C--O 1.215 -0.742 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -44.5 -23.14 0.1 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 131.173 3.789 . . . . 0.0 114.993 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -45.64 140.35 3.41 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.616 1.966 . . . . 0.0 110.374 175.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -64.76 -14.65 59.7 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.384 -0.823 . . . . 0.0 111.981 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -54.13 -52.41 61.16 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 118.228 -0.892 . . . . 0.0 112.793 -175.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -85.72 -26.23 26.0 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 117.034 -1.866 . . . . 0.0 109.0 -176.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 47.0 mt -58.64 -48.11 86.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -54.71 -54.54 40.47 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.513 -0.756 . . . . 0.0 110.467 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 29.8 t -60.67 -39.3 87.89 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.124 0.874 . . . . 0.0 110.299 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -68.96 -45.04 71.7 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.703 -0.623 . . . . 0.0 110.752 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.4 -33.56 76.16 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.319 1.048 . . . . 0.0 111.18 176.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -66.33 -51.51 56.54 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.444 1.498 . . . . 0.0 108.164 175.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -56.08 -45.07 79.48 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.237 0.926 . . . . 0.0 109.05 175.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.01 -2.84 8.41 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.876 1.27 . . . . 0.0 114.156 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -76.26 55.5 3.21 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.215 1.388 . . . . 0.0 111.759 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -100.81 66.96 0.5 Allowed Glycine 0 CA--C 1.519 0.33 0 N-CA-C 109.915 -1.274 . . . . 0.0 109.915 178.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -144.86 113.36 6.65 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.451 1.1 . . . . 0.0 108.571 176.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -70.7 149.15 47.26 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -140.91 102.05 4.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 175.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -149.0 149.36 31.02 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 175.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.02 136.3 13.03 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 127.403 2.281 . . . . 0.0 106.665 176.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -148.5 139.6 23.18 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 175.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 4.1 m 57.65 54.05 6.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -175.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.4 mp0 . . . . . 0 C--O 1.254 1.327 0 C-N-CA 129.563 3.145 . . . . 0.0 111.865 -175.395 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.648 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.8 mp -139.58 124.47 20.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 N-CA-C 105.873 -1.899 . . . . 0.0 105.873 -173.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -143.84 83.8 1.76 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-N 118.843 0.747 . . . . 0.0 109.006 176.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.21 163.92 30.5 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 175.491 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.72 78.18 8.48 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 175.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m -68.04 162.66 24.07 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 175.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.453 ' CG ' ' H ' ' A' ' 8' ' ' ILE . 14.9 ttmt -132.33 -179.35 5.38 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 120.964 -1.085 . . . . 0.0 109.282 -177.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.453 ' H ' ' CG ' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -139.82 150.53 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 124.795 1.238 . . . . 0.0 109.063 178.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -96.74 79.92 3.01 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 102.012 -3.329 . . . . 0.0 102.012 174.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -65.95 -24.24 66.77 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 117.819 -1.086 . . . . 0.0 112.953 -175.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -66.41 -56.11 12.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 176.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.83 -45.15 87.37 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 122.065 -0.397 . . . . 0.0 111.303 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.6 m -60.6 -40.37 91.55 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 118.484 -0.77 . . . . 0.0 111.224 176.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -62.21 -32.87 73.58 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.586 178.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.33 9.07 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 120.242 1.383 . . . . 0.0 110.014 176.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.45 -48.36 71.81 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.823 -0.548 . . . . 0.0 111.828 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -52.86 -48.59 66.96 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 124.004 0.922 . . . . 0.0 110.436 175.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.69 -43.83 98.1 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 117.1 -1.429 . . . . 0.0 110.677 -178.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.6 mp -58.01 -60.53 3.58 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 119.483 1.038 . . . . 0.0 109.534 175.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 43.9 t -59.74 -31.64 47.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 121.846 -0.534 . . . . 0.0 111.407 -176.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -73.33 -26.7 61.15 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.437 -0.79 . . . . 0.0 111.296 176.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -80.15 123.73 28.16 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.22 0.918 . . . . 0.0 110.025 -176.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.406 ' CG ' HH12 ' A' ' 66' ' ' ARG . 1.5 m-20 -64.28 -23.0 67.15 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 123.66 0.784 . . . . 0.0 110.367 175.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.13 -3.87 88.67 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.075 1.798 . . . . 0.0 114.303 177.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.3 t -85.77 130.64 34.5 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.766 1.783 . . . . 0.0 109.608 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.6 -35.98 75.79 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 175.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 t -63.17 131.04 28.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -114.39 -23.6 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 126.034 1.733 . . . . 0.0 110.503 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 37.5 p-90 -131.09 141.77 50.2 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.296 1.039 . . . . 0.0 111.092 178.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.2 t -137.1 147.22 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 175.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.434 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 40.3 p -103.8 162.43 13.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.082 0.468 . . . . 0.0 109.83 178.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -134.32 141.82 47.05 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.768 1.627 . . . . 0.0 107.132 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -124.82 176.82 6.36 Favored 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 125.356 1.463 . . . . 0.0 107.569 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -113.9 145.05 42.04 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.456 0.646 . . . . 0.0 110.312 176.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -129.92 123.46 30.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 103.408 -2.812 . . . . 0.0 103.408 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 38.05 -94.28 0.01 OUTLIER Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.26 1.41 . . . . 0.0 113.883 -176.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.4 p -124.71 34.51 4.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.142 1.777 . . . . 0.0 112.994 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -144.71 172.86 12.41 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.321 1.048 . . . . 0.0 112.194 175.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.4 mm -98.4 132.35 43.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 C-N-CA 125.455 1.502 . . . . 0.0 107.028 176.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.5 m -120.65 160.52 43.94 Favored Pre-proline 0 C--O 1.235 0.327 0 C-N-CA 124.879 1.272 . . . . 0.0 110.251 175.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.02 160.88 44.85 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 120.971 1.114 . . . . 0.0 110.84 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -128.87 -173.11 13.33 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 106.837 -2.505 . . . . 0.0 106.837 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -69.8 171.59 8.98 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.822 -0.811 . . . . 0.0 111.212 177.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 -142.11 171.63 13.8 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.085 1.354 . . . . 0.0 111.749 -175.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.99 167.7 39.91 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-O 122.085 0.825 . . . . 0.0 112.695 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.93 -9.05 13.66 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 127.529 2.332 . . . . 0.0 112.474 -175.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.23 144.9 45.1 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 104.964 -2.235 . . . . 0.0 104.964 -177.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -84.06 -15.85 45.99 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -175.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -58.19 -37.22 74.35 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 120.916 1.689 . . . . 0.0 110.138 -178.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -73.38 -21.8 60.42 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.328 -0.857 . . . . 0.0 112.189 176.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -62.1 -46.47 88.91 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 120.423 1.465 . . . . 0.0 109.535 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.4 mp -61.39 -37.69 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -65.59 -39.04 91.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 122.668 0.387 . . . . 0.0 111.368 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -73.13 -24.02 60.55 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 126.543 1.937 . . . . 0.0 114.729 -175.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 85.1 m -63.67 118.12 7.8 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.836 ' HG1' ' CG2' ' A' ' 59' ' ' VAL 0.289 2.3 p -82.72 163.2 21.47 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 122.662 1.22 . . . . 0.0 111.458 -175.712 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -46.6 -75.48 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 130.655 3.582 . . . . 0.0 115.949 -175.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -102.04 -36.63 8.51 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -175.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.836 ' CG2' ' HG1' ' A' ' 56' ' ' THR . 18.5 m -62.12 166.98 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 -175.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -107.42 135.17 49.35 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 175.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.4 tp -132.29 170.82 14.51 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.179 1.792 . . . . 0.0 108.585 -175.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -136.33 157.03 47.77 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 124.537 1.135 . . . . 0.0 108.354 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.434 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -152.67 129.71 11.09 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 119.17 0.895 . . . . 0.0 112.875 175.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -89.78 123.52 33.84 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 105.154 -2.165 . . . . 0.0 105.154 175.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.5 t -138.93 149.93 23.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 122.865 0.466 . . . . 0.0 110.61 -175.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.406 HH12 ' CG ' ' A' ' 23' ' ' ASP . 11.0 ttp180 -103.28 145.5 29.86 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.108 0.963 . . . . 0.0 110.325 175.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -136.5 149.9 48.4 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.131 1.373 . . . . 0.0 110.728 -176.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.7 m -96.06 122.95 39.44 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 87.2 m -90.17 171.59 9.4 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.442 -0.786 . . . . 0.0 109.317 -176.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.62 114.57 6.4 Favored Glycine 0 C--N 1.339 0.705 0 N-CA-C 109.036 -1.626 . . . . 0.0 109.036 175.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -70.1 169.9 12.57 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 127.31 2.244 . . . . 0.0 111.767 -175.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.481 ' C ' ' H ' ' A' ' 74' ' ' SER . . . -146.57 -172.76 4.04 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 131.172 3.789 . . . . 0.0 105.597 175.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 87.0 mtp -49.42 -2.87 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 126.968 2.107 . . . . 0.0 113.895 175.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.481 ' H ' ' C ' ' A' ' 72' ' ' ALA . 68.9 m -145.77 128.25 16.0 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.45 3.5 . . . . 0.0 103.06 175.206 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -64.4 162.76 14.45 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -175.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 67.3 mtt180 -136.16 154.2 51.04 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 122.773 1.273 . . . . 0.0 110.732 -176.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 47.8 t -145.75 160.0 42.37 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 177.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -144.27 168.11 20.85 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 104.824 -2.287 . . . . 0.0 104.824 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -121.55 139.77 53.08 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 105.744 -1.947 . . . . 0.0 105.744 176.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -123.94 114.03 19.26 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 104.817 -2.29 . . . . 0.0 104.817 -176.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -89.09 113.29 24.42 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 102.892 -3.003 . . . . 0.0 102.892 175.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -88.59 140.35 15.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -125.96 123.18 37.95 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 102.232 -3.247 . . . . 0.0 102.232 175.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 48.2 t-105 -101.6 123.85 46.28 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 25.4 mt -142.2 78.39 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.09 149.96 11.0 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 108.792 -1.723 . . . . 0.0 108.792 175.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -68.19 -10.72 56.46 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.43 2.115 . . . . 0.0 113.001 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -83.6 -36.32 24.01 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 117.256 -1.354 . . . . 0.0 113.191 -175.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -53.21 133.92 15.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 CA-C-N 120.354 1.434 . . . . 0.0 110.049 175.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 31.4 t -58.72 156.48 10.96 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 123.209 1.481 . . . . 0.0 113.032 -175.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.64 -13.8 13.07 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 113.175 -1.83 . . . . 0.0 111.617 175.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.7 tp -72.01 -61.28 1.85 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 126.098 1.759 . . . . 0.0 110.621 175.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -68.55 -34.25 75.52 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.8 ttm180 -60.37 -42.66 96.27 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 175.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.27 -36.34 83.8 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-O 118.107 -0.949 . . . . 0.0 111.617 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -55.84 -38.38 69.99 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.945 1.248 . . . . 0.0 110.602 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 74.2 m -54.31 -34.52 61.16 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 119.739 1.154 . . . . 0.0 110.467 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.75 -25.73 70.65 Favored Glycine 0 CA--C 1.527 0.806 0 O-C-N 121.009 -1.057 . . . . 0.0 113.761 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.7 m -99.12 -13.41 19.81 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.589 1.956 . . . . 0.0 110.88 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -103.41 -24.11 13.5 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -174.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -59.73 -39.96 86.44 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 120.986 1.721 . . . . 0.0 111.149 -178.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.9 t -62.56 -31.22 71.98 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 118.611 -0.709 . . . . 0.0 110.732 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 15.4 mt -62.81 -63.2 1.28 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 119.416 1.007 . . . . 0.0 109.573 -176.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.07 -30.36 47.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 117.188 -1.387 . . . . 0.0 109.455 175.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -61.91 -37.27 84.0 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 121.288 1.858 . . . . 0.0 110.288 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -60.79 -24.64 65.96 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 120.201 1.364 . . . . 0.0 111.117 179.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 43.7 t -86.82 -53.03 11.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 79.2 t -74.95 26.11 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 130.393 3.477 . . . . 0.0 111.427 -177.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -55.32 -26.13 38.74 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 119.618 -1.926 . . . . 0.0 112.492 -176.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -95.55 90.55 5.78 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 175.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -157.96 176.74 12.15 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.948 1.299 . . . . 0.0 108.041 179.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -106.31 -66.5 1.0 Allowed 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.829 -0.544 . . . . 0.0 112.013 177.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 14.0 mtpt -146.06 168.9 19.81 Favored 'General case' 0 CA--C 1.504 -0.826 0 C-N-CA 126.812 2.045 . . . . 0.0 110.017 176.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.33 179.72 4.19 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.82 -1.082 . . . . 0.0 109.553 175.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.25 140.63 23.25 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 104.256 -2.498 . . . . 0.0 104.256 -176.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.8 t -114.27 123.72 70.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -125.99 138.39 54.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 106.131 -1.803 . . . . 0.0 106.131 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.0 p -131.51 1.79 4.11 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -175.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -137.12 134.2 36.14 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.816 0.734 . . . . 0.0 109.455 177.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 17.3 ttp-105 -69.15 -28.83 66.78 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 118.195 -0.907 . . . . 0.0 112.723 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -70.42 -45.38 66.01 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 120.853 1.661 . . . . 0.0 106.623 175.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -58.37 -43.84 88.59 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 117.907 -1.044 . . . . 0.0 109.351 -176.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -44.04 -23.74 0.11 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 129.568 3.147 . . . . 0.0 115.081 -177.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -50.44 154.91 1.16 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 122.502 1.144 . . . . 0.0 114.064 175.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -61.08 -15.66 35.17 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 115.119 -0.946 . . . . 0.0 113.18 175.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -51.43 -64.95 0.65 Allowed 'General case' 0 C--O 1.242 0.689 0 CA-C-N 119.11 0.868 . . . . 0.0 111.022 176.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.92 -26.59 54.26 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 114.984 -2.686 . . . . 0.0 109.389 -175.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.7 -41.23 91.9 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 C-N-CA 123.7 0.8 . . . . 0.0 108.885 -176.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -62.1 -53.0 61.64 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 120.028 1.285 . . . . 0.0 109.929 179.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 44.0 t -65.08 -34.67 78.96 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 119.222 -0.418 . . . . 0.0 110.538 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -72.56 -44.38 62.16 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 123.902 0.881 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 65.0 mt -61.79 -31.05 71.23 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 118.342 -0.837 . . . . 0.0 108.853 175.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -69.43 -52.76 23.76 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.368 1.067 . . . . 0.0 109.298 174.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -51.34 -56.85 10.88 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.328 1.051 . . . . 0.0 109.531 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -76.15 8.14 3.55 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.528 1.931 . . . . 0.0 113.794 177.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -113.87 -48.84 0.56 Allowed Glycine 0 C--N 1.335 0.496 0 CA-C-O 118.592 -1.116 . . . . 0.0 112.741 -175.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 138.79 175.08 13.76 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -176.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.25 153.86 42.68 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.294 0.568 . . . . 0.0 109.841 176.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -151.1 81.22 1.32 Allowed 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 104.543 -2.391 . . . . 0.0 104.543 175.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -148.02 116.46 6.6 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 130.536 3.534 . . . . 0.0 101.566 -176.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -128.99 154.96 46.1 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 105.391 -2.078 . . . . 0.0 105.391 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.1 102.56 2.96 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 125.371 1.469 . . . . 0.0 107.743 -175.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -147.97 149.22 31.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 125.777 1.631 . . . . 0.0 106.681 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 86.02 35.91 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 127.959 2.504 . . . . 0.0 108.452 -175.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 . . . . . 0 C--O 1.248 1.008 0 C-N-CA 129.569 3.148 . . . . 0.0 103.547 175.877 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.907 0 N-CA-C 110.087 -1.205 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 6.0 tp -146.89 -78.99 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.074 0.937 . . . . 0.0 110.857 173.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -74.74 97.02 3.15 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.178 0.991 . . . . 0.0 109.882 -175.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -147.26 171.32 15.59 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -120.15 92.84 3.87 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 127.747 2.419 . . . . 0.0 107.074 176.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.4 m -119.05 170.89 8.66 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.63 1.972 . . . . 0.0 105.754 -177.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.0 tttt -139.04 176.28 8.83 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.612 -1.305 . . . . 0.0 111.247 -176.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.82 152.21 24.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 124.115 0.966 . . . . 0.0 108.961 175.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -100.34 78.6 2.05 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 104.678 -2.341 . . . . 0.0 104.678 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -61.89 -27.78 69.04 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.098 -0.953 . . . . 0.0 112.506 -175.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.22 -48.36 70.85 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 119.822 1.192 . . . . 0.0 110.255 177.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.16 -52.87 20.12 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.729 0.412 . . . . 0.0 110.121 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.9 m -62.31 -30.56 71.24 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.102 -0.951 . . . . 0.0 111.379 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.2 ttt180 -62.18 -35.19 78.1 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 115.946 -1.978 . . . . 0.0 109.112 175.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.87 -59.78 4.19 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 121.033 1.742 . . . . 0.0 109.906 -177.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.32 95.35 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.968 -0.458 . . . . 0.0 111.919 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -54.76 -46.31 74.34 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 175.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -58.07 -47.75 82.23 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.213 1.405 . . . . 0.0 110.102 -175.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -57.19 -62.92 1.42 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.014 0.926 . . . . 0.0 109.855 175.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.1 t -60.2 -24.95 32.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 O-C-N 121.559 -0.713 . . . . 0.0 112.244 -176.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -75.73 -31.33 59.57 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.45 1.1 . . . . 0.0 111.725 175.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.24 125.29 33.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 127.687 2.395 . . . . 0.0 112.665 -175.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.66 -19.47 58.4 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.232 1.013 . . . . 0.0 112.843 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.99 -10.09 86.42 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.015 1.293 . . . . 0.0 113.464 176.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.6 t -79.61 127.52 32.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 119.326 1.563 . . . . 0.0 109.053 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.36 -35.73 73.73 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 175.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.6 t -64.38 133.2 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 127.633 2.373 . . . . 0.0 108.571 175.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 pp -115.94 -23.66 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 126.109 1.763 . . . . 0.0 111.46 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 51.0 p-90 -123.57 147.87 46.88 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.838 0.855 . . . . 0.0 109.74 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.9 t -137.07 162.92 33.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 129.513 3.125 . . . . 0.0 107.835 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.434 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 41.3 p -125.18 159.15 32.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.61 1.164 . . . . 0.0 109.075 175.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -132.44 123.8 27.36 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -102.86 176.23 5.22 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 175.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -128.53 129.41 45.98 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 -175.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -129.08 131.02 47.23 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.919 1.688 . . . . 0.0 106.487 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 45.53 -114.53 1.28 Allowed Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.114 -1.195 . . . . 0.0 110.114 -176.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 p -120.74 45.61 2.2 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.968 1.307 . . . . 0.0 111.208 176.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.5 t -142.93 169.42 17.6 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.7 mm -98.61 139.4 20.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 175.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.3 m -128.53 146.18 58.94 Favored Pre-proline 0 N--CA 1.469 0.491 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.289 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.14 150.22 59.44 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 121.988 1.792 . . . . 0.0 109.288 175.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -124.3 -157.57 9.8 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 125.784 1.659 . . . . 0.0 110.629 177.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -51.56 161.5 0.49 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 125.906 1.682 . . . . 0.0 112.277 176.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.4 164.95 33.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.57 1.148 . . . . 0.0 109.124 176.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.73 176.96 44.05 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 123.578 0.609 . . . . 0.0 111.751 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -107.79 -15.61 14.52 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.355 1.462 . . . . 0.0 113.533 -176.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -123.63 142.63 50.86 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 -176.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -83.36 -8.91 59.33 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.799 1.036 . . . . 0.0 113.799 -174.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -54.1 -36.85 63.64 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.846 1.203 . . . . 0.0 110.137 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -62.68 -28.81 70.19 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.044 1.337 . . . . 0.0 112.158 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -63.52 -52.45 61.16 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -178.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.52 -36.78 76.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -176.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -60.83 -31.88 71.29 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.67 0.788 . . . . 0.0 112.102 175.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -85.67 -24.04 27.19 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.008 0.923 . . . . 0.0 113.455 -175.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 96.6 m -59.85 120.75 10.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.602 1.092 . . . . 0.0 112.539 -175.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 2.4 p -104.92 -173.53 2.32 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 127.181 2.192 . . . . 0.0 113.898 -178.219 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -73.67 -75.93 0.14 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 129.619 3.168 . . . . 0.0 117.964 -175.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -102.35 -24.76 13.83 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.051 1.74 . . . . 0.0 115.353 -174.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.7 m -63.94 158.78 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 CA-C-O 122.816 1.293 . . . . 0.0 112.37 -175.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.3 ptt-85 -108.41 130.65 55.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 102.894 -3.002 . . . . 0.0 102.894 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 31.8 tp -140.7 156.09 46.3 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -175.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -131.38 148.72 52.69 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.434 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.94 129.16 16.69 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.344 0.658 . . . . 0.0 111.629 -179.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -96.44 123.64 40.16 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 175.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.3 t -134.39 141.4 43.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 123.426 0.69 . . . . 0.0 109.304 -175.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -85.06 137.84 32.8 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 175.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -131.49 168.22 18.01 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 127.648 2.379 . . . . 0.0 106.622 -176.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.3 m -130.48 143.81 51.0 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 121.069 -1.02 . . . . 0.0 108.739 -177.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 3.6 m -83.48 160.76 21.45 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 120.839 -1.163 . . . . 0.0 108.018 175.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -54.08 135.18 43.93 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 108.691 -1.764 . . . . 0.0 108.691 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -46.49 136.64 7.32 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 128.269 2.628 . . . . 0.0 112.491 -175.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -138.98 179.75 6.31 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.135 1.774 . . . . 0.0 109.096 176.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 23.9 mmt -61.78 -5.71 2.18 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.832 1.253 . . . . 0.0 113.532 179.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.4 m -146.09 136.59 24.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.059 1.743 . . . . 0.0 106.547 175.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -46.16 152.84 0.37 Allowed 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.35 1.86 . . . . 0.0 113.254 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 -121.21 148.32 44.42 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 123.638 0.775 . . . . 0.0 109.881 -176.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.6 t -146.89 137.82 23.92 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.658 1.583 . . . . 0.0 109.168 175.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.4 mmpt? -145.99 176.04 10.0 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 127.998 2.519 . . . . 0.0 108.115 175.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -141.56 146.36 36.23 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 176.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -125.47 122.44 36.65 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 176.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -97.65 113.33 25.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 100.421 -3.918 . . . . 0.0 100.421 174.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.9 mp -97.36 144.71 10.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -123.62 123.36 40.4 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 103.258 -2.867 . . . . 0.0 103.258 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -96.04 123.48 39.66 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 103.716 -2.698 . . . . 0.0 103.716 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.3 mt -144.91 97.77 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 104.134 -2.543 . . . . 0.0 104.134 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.62 166.02 4.75 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-O 121.717 0.621 . . . . 0.0 113.07 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -75.78 -19.23 59.15 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.213 -1.757 . . . . 0.0 110.009 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -82.72 -20.71 35.49 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 120.812 -1.18 . . . . 0.0 113.486 -175.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . 0.257 0.8 OUTLIER -66.33 140.16 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 119.852 1.205 . . . . 0.0 113.373 -177.777 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 47.7 t -70.88 144.59 50.62 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 126.136 1.774 . . . . 0.0 109.89 179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -60.51 -21.16 57.11 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-O 119.179 -0.79 . . . . 0.0 113.205 179.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 tt -65.06 -32.58 74.36 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.872 1.336 . . . . 0.0 110.062 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -80.09 -44.07 20.66 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 175.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.8 ttp85 -58.62 -25.03 62.24 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.514 1.052 . . . . 0.0 111.298 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.34 70.57 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 120.849 -1.157 . . . . 0.0 111.861 175.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -64.99 -39.12 92.99 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-O 118.032 -0.985 . . . . 0.0 108.764 175.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.5 m -54.26 -34.81 61.64 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.383 0.673 . . . . 0.0 110.137 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.67 -12.37 56.37 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 125.135 1.35 . . . . 0.0 114.805 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.6 m -125.45 2.7 7.68 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.784 2.034 . . . . 0.0 110.603 175.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -103.62 -42.93 5.51 Favored 'General case' 0 C--O 1.226 -0.157 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -177.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.46 ' HE2' ' HG3' ' A' ' 114' ' ' GLU . 9.3 mtpm? -59.59 -28.81 67.49 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.52 -1.363 . . . . 0.0 112.44 -176.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.5 t -68.14 -47.01 69.23 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.458 1.503 . . . . 0.0 108.855 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 14.5 mt -59.44 -58.04 10.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.855 1.662 . . . . 0.0 109.987 -176.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.4 p -62.21 -30.93 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-O 117.27 -1.347 . . . . 0.0 109.667 176.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.82 -31.16 72.24 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 121.178 1.808 . . . . 0.0 110.893 176.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -63.57 -25.73 68.37 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 120.154 1.343 . . . . 0.0 111.099 176.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 57.5 t -86.19 -56.97 4.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 175.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 86.3 t -73.01 26.65 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 131.106 3.762 . . . . 0.0 112.127 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -52.76 -21.63 4.34 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 119.679 -1.888 . . . . 0.0 113.717 -176.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -99.02 84.39 3.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 174.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -147.42 170.11 18.07 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 175.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 -66.32 0.91 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -176.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -152.85 169.26 23.25 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 127.12 2.168 . . . . 0.0 108.159 175.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.46 ' HG3' ' HE2' ' A' ' 101' ' ' LYS . 0.7 OUTLIER -107.19 167.77 9.68 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 175.193 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -137.6 152.17 49.11 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 -175.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.8 t -121.24 124.87 72.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 175.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mp -124.94 141.47 44.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 176.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.2 p -130.89 6.46 4.65 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.304 1.442 . . . . 0.0 112.827 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -139.81 128.87 23.65 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.573 0.624 . . . . 0.0 111.305 175.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 -64.99 -32.87 74.8 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 124.778 1.231 . . . . 0.0 113.966 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.479 ' H ' ' HE3' ' A' ' 121' ' ' LYS . 0.3 OUTLIER -76.21 -41.04 50.69 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 120.98 1.718 . . . . 0.0 109.667 176.622 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.9 -37.42 86.88 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.022 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -45.0 -23.65 0.16 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 129.382 3.073 . . . . 0.0 115.076 -176.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -44.41 140.19 2.4 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.74 1.216 . . . . 0.0 110.856 175.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.29 -14.56 2.94 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -54.01 -55.6 25.78 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 124.345 1.058 . . . . 0.0 111.97 177.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.42 -25.7 35.96 Favored 'General case' 0 C--N 1.352 0.682 0 C-N-CA 116.614 -2.035 . . . . 0.0 108.713 -177.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 64.8 mt -60.74 -49.04 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -55.61 -51.33 67.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.266 0.626 . . . . 0.0 109.878 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.0 t -63.88 -38.55 91.5 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.454 0.702 . . . . 0.0 111.007 -176.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -67.91 -40.29 83.46 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.838 1.255 . . . . 0.0 109.688 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 96.7 mt -72.82 -24.69 60.94 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.07 -1.018 . . . . 0.0 110.339 175.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.6 mtpt -73.78 -47.29 39.97 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 125.185 1.394 . . . . 0.0 108.403 175.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -54.01 -65.41 0.57 Allowed 'General case' 0 C--O 1.234 0.251 0 C-N-CA 126.247 1.819 . . . . 0.0 108.508 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.61 -13.34 41.22 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 176.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -65.03 -18.7 64.99 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 125.267 1.413 . . . . 0.0 111.847 176.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -76.16 97.49 1.16 Allowed Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 104.047 -3.621 . . . . 0.0 104.047 175.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.28 99.91 0.15 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.596 0.758 . . . . 0.0 110.064 -176.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -128.69 79.95 1.94 Allowed 'General case' 0 C--O 1.235 0.322 0 N-CA-C 103.709 -2.7 . . . . 0.0 103.709 175.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -139.47 90.74 2.43 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.93 150.04 45.91 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 125.418 1.487 . . . . 0.0 109.392 175.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.22 123.25 5.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 126.36 1.864 . . . . 0.0 106.559 175.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 96.6 mm-40 -115.45 168.4 10.02 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 175.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.7 m 54.69 43.06 30.73 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 122.005 0.907 . . . . 0.0 108.852 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 . . . . . 0 C--O 1.249 1.036 0 O-C-N 120.942 -1.099 . . . . 0.0 110.024 176.945 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.773 0 N-CA-C 109.901 -1.28 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 42.2 mm -54.07 123.2 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 C-N-CA 124.264 1.026 . . . . 0.0 110.397 -171.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 76.7 mtt85 -95.54 123.29 39.02 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 10.5 tpt -155.6 171.97 19.06 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -176.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.69 63.27 5.89 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 m -71.01 149.29 46.77 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.163 2.185 . . . . 0.0 106.283 175.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.6 mtmt -132.02 179.97 5.77 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.091 0.956 . . . . 0.0 109.413 -176.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.25 153.67 24.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 C-N-CA 124.129 0.971 . . . . 0.0 110.189 176.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -91.57 80.57 5.39 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 103.682 -2.71 . . . . 0.0 103.682 175.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -62.88 -27.4 69.33 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 117.383 -1.294 . . . . 0.0 111.94 -175.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -72.33 -53.9 11.05 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 119.64 1.109 . . . . 0.0 109.236 178.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.39 -43.82 96.47 Favored 'General case' 0 CA--C 1.527 0.069 0 CA-C-N 118.342 0.519 . . . . 0.0 111.064 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 81.2 m -70.27 -30.6 67.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.373 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -61.15 -34.54 75.18 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-O 116.834 -1.555 . . . . 0.0 109.853 176.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.28 -57.73 10.08 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 119.753 1.161 . . . . 0.0 110.157 -177.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.86 -41.94 86.5 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -52.7 -40.13 62.67 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 123.312 0.645 . . . . 0.0 111.104 175.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -63.21 -45.06 93.46 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.81 0.844 . . . . 0.0 110.574 -176.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.53 -50.68 72.57 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 123.853 0.861 . . . . 0.0 110.605 175.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.6 t -65.99 -30.52 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-O 119.49 -0.29 . . . . 0.0 111.218 -178.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -66.5 -48.84 68.54 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 118.077 -0.964 . . . . 0.0 108.725 175.764 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 21' ' ' ARG . 7.5 t70 -62.16 140.53 58.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 123.981 0.801 . . . . 0.0 112.289 -175.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -78.75 -19.51 52.13 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 117.566 -1.207 . . . . 0.0 113.691 -175.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -105.99 -1.66 39.14 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 118.846 -0.975 . . . . 0.0 114.096 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 t -71.74 147.95 46.85 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.365 1.582 . . . . 0.0 109.133 176.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.88 -33.11 59.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.328 176.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.7 t -74.79 123.48 30.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 175.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.2 pp -114.64 -23.89 4.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 C-N-CA 124.289 1.035 . . . . 0.0 110.874 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.402 ' CZ2' ' HA3' ' A' ' 45' ' ' GLY . 34.3 p-90 -124.64 144.98 49.89 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.632 0.773 . . . . 0.0 109.194 178.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.8 t -135.68 161.93 37.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 127.113 2.165 . . . . 0.0 107.594 176.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.474 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 72.3 p -125.55 157.83 36.1 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 175.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -127.5 123.71 36.57 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 176.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -94.46 176.01 6.46 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -119.65 137.5 53.84 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -137.47 123.97 20.86 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 50.67 -110.88 1.03 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.5 p -110.71 27.39 9.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.648 1.579 . . . . 0.0 112.56 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -148.07 172.6 14.01 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 119.25 0.932 . . . . 0.0 113.143 176.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.8 mm -99.0 134.19 38.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 105.063 -2.199 . . . . 0.0 105.063 175.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.1 m -127.66 159.62 65.08 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 123.186 0.594 . . . . 0.0 111.262 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.99 144.19 57.27 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 121.809 1.673 . . . . 0.0 110.428 175.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -113.83 -155.05 11.4 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 125.827 1.679 . . . . 0.0 110.078 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -63.56 159.61 18.38 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.688 1.195 . . . . 0.0 110.808 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -143.96 165.97 26.27 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 125.523 1.529 . . . . 0.0 109.043 176.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.402 ' HA3' ' CZ2' ' A' ' 29' ' ' TRP . . . -178.51 -175.65 45.78 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 124.016 0.817 . . . . 0.0 111.818 -176.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -118.39 -22.7 7.51 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.215 1.406 . . . . 0.0 112.465 -176.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -115.07 130.5 56.95 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 -176.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -83.04 -7.57 59.64 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.042 0.837 . . . . 0.0 111.456 -175.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -54.23 -37.16 64.3 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.283 -1.511 . . . . 0.0 111.69 175.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -70.11 -26.86 64.16 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.829 1.252 . . . . 0.0 112.444 177.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -62.49 -46.61 87.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.472 1.509 . . . . 0.0 109.477 -177.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 mp -61.12 -42.07 91.8 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -177.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -65.57 -24.01 66.98 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.369 0.531 . . . . 0.0 112.425 176.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -80.93 -23.9 38.56 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.842 1.201 . . . . 0.0 112.251 176.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 99.1 m -60.16 123.56 17.54 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 104.284 -2.488 . . . . 0.0 104.284 175.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 72.7 p -82.84 174.04 11.3 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -174.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.437 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 7.3 p-10 -60.76 -76.55 0.05 OUTLIER 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.433 2.293 . . . . 0.0 109.424 176.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.437 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 14.6 t70 -106.4 -36.53 6.79 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -175.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.5 m -60.62 165.7 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.293 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -174.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 28.1 ptt-85 -103.77 151.62 22.83 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 175.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.8 tp -148.65 161.53 41.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -127.16 151.07 49.16 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.474 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.58 157.87 43.92 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.088 0.555 . . . . 0.0 111.842 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -131.37 123.78 28.95 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 -178.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 39.6 t -137.67 141.63 38.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -175.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.2 ttp-105 -83.99 138.31 33.18 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 175.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -136.13 153.58 51.25 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 125.474 1.509 . . . . 0.0 107.837 -177.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 92.3 m -123.01 113.31 18.89 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 121.124 -0.985 . . . . 0.0 109.122 -179.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.8 m -156.67 141.11 16.7 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.46 113.65 0.06 OUTLIER Glycine 0 CA--C 1.507 -0.417 0 N-CA-C 106.189 -2.764 . . . . 0.0 106.189 -175.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -123.9 176.27 6.42 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 126.015 1.726 . . . . 0.0 111.643 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 74' ' ' SER . . . -141.98 -173.1 3.72 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 129.398 3.079 . . . . 0.0 106.304 178.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -55.88 0.46 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.467 1.507 . . . . 0.0 113.559 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.445 ' H ' ' C ' ' A' ' 72' ' ' ALA . 66.5 m -146.4 152.65 39.41 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 128.622 2.769 . . . . 0.0 105.4 175.219 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -61.32 155.4 21.36 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.583 0.706 . . . . 0.0 109.847 -177.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 46.6 mtp180 -133.55 176.32 8.65 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 126.044 1.738 . . . . 0.0 109.351 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 8.5 t -142.35 160.17 40.79 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 124.473 1.109 . . . . 0.0 110.109 -176.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -145.06 171.57 14.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 130.852 3.661 . . . . 0.0 106.608 176.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -143.18 143.44 31.78 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 175.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.57 118.3 31.77 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 178.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -87.88 113.7 23.79 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 101.988 -3.338 . . . . 0.0 101.988 175.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.6 mp -101.31 143.14 14.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 -176.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -125.69 123.58 39.23 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 175.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -93.37 123.72 36.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 104.868 -2.271 . . . . 0.0 104.868 175.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.8 mt -143.12 92.29 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -58.93 156.11 24.84 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 108.308 -1.917 . . . . 0.0 108.308 175.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -74.33 -4.43 36.25 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 119.997 -1.884 . . . . 0.0 111.084 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -83.83 -36.4 23.52 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 121.254 -0.904 . . . . 0.0 110.771 -175.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.5 p -64.45 128.99 27.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 175.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.4 t -60.5 154.33 21.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.527 1.156 . . . . 0.0 111.745 -175.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -53.67 -30.84 44.19 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 125.59 1.567 . . . . 0.0 113.179 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.6 tt -62.97 -41.44 99.55 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.489 1.116 . . . . 0.0 111.12 178.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -76.92 -41.24 44.29 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.45 -35.0 62.53 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.64 1.109 . . . . 0.0 109.806 175.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.37 -30.25 64.72 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 119.877 1.217 . . . . 0.0 113.412 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 23.7 mmtp -57.88 -31.91 67.17 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 119.384 0.993 . . . . 0.0 110.833 175.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.5 m -56.65 -33.98 66.87 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.493 1.042 . . . . 0.0 109.933 -178.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.23 -14.97 67.14 Favored Glycine 0 CA--C 1.535 1.324 0 CA-C-O 119.143 -0.81 . . . . 0.0 113.834 177.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.8 m -112.32 -4.62 14.27 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.684 2.394 . . . . 0.0 110.245 176.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -104.48 -35.36 7.92 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 124.257 1.023 . . . . 0.0 111.532 -175.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -59.6 -34.71 73.09 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.108 -0.995 . . . . 0.0 111.058 -177.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 7.0 t -66.98 -33.87 76.52 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.804 1.241 . . . . 0.0 110.369 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 13.2 mt -70.91 -63.29 1.13 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.687 1.195 . . . . 0.0 108.88 -176.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.267 0.9 OUTLIER -59.46 -25.2 30.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-O 117.909 -1.043 . . . . 0.0 109.537 175.562 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -61.8 -41.97 98.42 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 120.909 1.686 . . . . 0.0 108.818 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -51.03 -31.03 17.08 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 120.704 1.593 . . . . 0.0 111.75 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 96.4 t -85.32 -63.57 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 124.685 1.194 . . . . 0.0 108.096 175.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 45.0 t -71.14 26.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 C-N-CA 130.566 3.546 . . . . 0.0 112.824 -175.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -57.63 -26.96 62.35 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.776 -1.828 . . . . 0.0 113.525 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -91.56 79.87 5.45 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 175.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -144.0 165.05 28.84 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 123.225 0.61 . . . . 0.0 109.569 177.725 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.63 -66.63 0.89 Allowed 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.36 175.72 12.8 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 126.451 1.901 . . . . 0.0 109.176 -175.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -115.41 164.51 14.17 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 123.429 0.456 . . . . 0.0 110.67 175.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -139.95 142.22 36.39 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 102.659 -3.089 . . . . 0.0 102.659 -175.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.34 128.5 73.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 176.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -128.25 145.14 35.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 125.985 1.714 . . . . 0.0 106.796 -176.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 42.0 p -131.31 -7.07 3.79 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.558 1.143 . . . . 0.0 113.464 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -116.73 130.08 56.51 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 15.2 ttp-105 -72.88 -28.54 62.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 118.61 -0.71 . . . . 0.0 111.964 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -69.89 -45.79 66.88 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 119.503 1.047 . . . . 0.0 109.017 175.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -53.55 -47.36 70.09 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 124.434 1.094 . . . . 0.0 110.16 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -43.91 -24.11 0.12 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 128.483 2.713 . . . . 0.0 116.793 -175.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -44.6 143.38 1.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 124.097 0.959 . . . . 0.0 110.636 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -60.33 -21.19 61.75 Favored 'General case' 0 C--N 1.341 0.213 0 O-C-N 121.587 -0.695 . . . . 0.0 111.024 -178.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -46.1 -59.17 3.03 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 125.34 1.456 . . . . 0.0 112.308 -175.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -81.15 -26.33 36.17 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 115.933 -2.307 . . . . 0.0 109.274 -176.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 36.2 mt -57.83 -44.07 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -60.34 -50.22 74.49 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 123.54 0.736 . . . . 0.0 111.64 -175.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -75.7 -30.68 59.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.554 0.616 . . . . 0.0 111.368 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.09 -46.46 81.02 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.044 -1.035 . . . . 0.0 108.922 176.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.64 -26.16 67.69 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.084 0.954 . . . . 0.0 111.648 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -63.59 -60.54 3.2 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 175.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? -53.82 -57.36 11.19 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 123.652 0.595 . . . . 0.0 110.474 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.21 -24.72 66.54 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -176.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.82 -2.96 83.81 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.743 1.639 . . . . 0.0 113.677 177.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 106.89 -5.43 36.73 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 125.595 1.569 . . . . 0.0 114.337 175.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -85.37 86.01 7.4 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 119.69 1.745 . . . . 0.0 108.03 176.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -144.49 107.4 4.49 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 105.683 -1.969 . . . . 0.0 105.683 176.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -142.71 116.23 9.12 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 -175.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -116.57 117.28 29.44 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 104.637 -2.357 . . . . 0.0 104.637 175.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -147.12 136.05 22.28 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 127.435 2.294 . . . . 0.0 105.18 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -144.65 140.5 28.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 -175.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 86.3 55.88 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 128.207 2.603 . . . . 0.0 109.66 -178.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 . . . . . 0 C--O 1.249 1.076 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 175.575 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 122.614 1.197 . . . . 0.0 108.105 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.6 m -83.72 172.64 12.05 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.417 2.287 . . . . 0.0 107.538 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.503 ' HG3' ' H ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -150.14 -177.12 5.74 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 119.908 -1.745 . . . . 0.0 111.298 -175.407 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.503 ' H ' ' HG3' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -142.8 146.75 21.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 C-N-CA 127.312 2.245 . . . . 0.0 105.384 175.073 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -92.07 83.42 5.13 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 102.167 -3.271 . . . . 0.0 102.167 174.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.9 pttt -58.22 -33.48 69.37 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-O 117.167 -1.397 . . . . 0.0 113.064 -175.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -78.03 -44.26 27.0 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 120.354 1.434 . . . . 0.0 110.353 -176.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.8 -40.06 94.61 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 119.249 0.932 . . . . 0.0 110.537 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 62.0 m -72.45 -34.8 68.01 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.45 -0.781 . . . . 0.0 110.625 178.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.98 -35.97 74.1 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.904 175.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.14 -54.15 49.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 119.071 0.851 . . . . 0.0 109.997 -176.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.41 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -67.46 -40.96 85.35 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.665 0.666 . . . . 0.0 111.297 177.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -50.62 -47.89 58.18 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.264 0.626 . . . . 0.0 110.781 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -54.66 -41.04 69.67 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.899 1.28 . . . . 0.0 111.636 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 mp -68.81 -61.52 1.77 Allowed 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 124.183 0.993 . . . . 0.0 110.697 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.3 t -55.83 -31.55 30.19 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.783 -175.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -29.98 67.83 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.617 1.099 . . . . 0.0 111.916 175.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -85.6 125.84 33.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.665 1.121 . . . . 0.0 112.546 -175.264 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -61.79 -15.8 44.5 Favored 'General case' 0 C--N 1.344 0.346 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 175.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.91 -9.37 57.35 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 125.286 1.422 . . . . 0.0 112.61 176.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.0 t -66.8 127.08 31.11 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 120.338 2.069 . . . . 0.0 108.162 175.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.8 -32.73 73.97 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.7 t -72.57 123.69 27.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 104.424 -2.436 . . . . 0.0 104.424 175.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -113.29 -25.27 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 C-N-CA 123.33 0.652 . . . . 0.0 109.974 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 24.7 p-90 -126.03 145.87 50.13 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 121.838 0.828 . . . . 0.0 109.418 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.41 HG21 ' HB1' ' A' ' 16' ' ' ALA . 6.0 t -138.33 159.97 31.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 127.664 2.386 . . . . 0.0 106.024 175.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 35.4 p -120.2 153.54 36.12 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 175.387 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -122.3 123.7 42.03 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 104.805 -2.295 . . . . 0.0 104.805 175.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 41.6 mmtt -102.37 176.46 5.17 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.538 1.935 . . . . 0.0 105.999 -177.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -126.44 152.32 46.56 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 175.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -146.63 163.92 34.3 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 125.888 1.675 . . . . 0.0 107.564 175.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 24.36 -88.18 0.01 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 128.51 2.957 . . . . 0.0 115.311 178.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 27.0 p -136.12 26.74 3.23 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.726 1.211 . . . . 0.0 110.154 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -142.53 157.24 44.94 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -175.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 1.8 mp -84.99 142.95 12.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 N-CA-C 103.935 -2.617 . . . . 0.0 103.935 175.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.46 161.72 57.34 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 125.398 1.479 . . . . 0.0 110.206 -177.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -71.41 152.89 61.02 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 121.572 1.515 . . . . 0.0 110.169 175.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -120.86 -152.37 8.82 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 126.103 1.811 . . . . 0.0 109.767 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.19 163.11 10.74 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.243 1.417 . . . . 0.0 110.458 175.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -141.77 161.19 38.56 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 126.455 1.902 . . . . 0.0 109.429 177.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -176.09 -179.66 46.68 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-O 121.981 0.767 . . . . 0.0 112.623 177.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.6 -13.93 9.13 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.433 1.493 . . . . 0.0 112.534 -176.326 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -120.73 130.98 54.28 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.524 1.13 . . . . 0.0 107.958 -175.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -83.48 -13.08 55.45 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -175.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -57.81 -43.48 85.75 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 119.776 -1.827 . . . . 0.0 109.635 175.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -68.85 -21.93 64.25 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 119.048 -0.501 . . . . 0.0 111.585 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -61.45 -43.86 98.12 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 120.373 1.442 . . . . 0.0 107.9 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.3 mm -56.71 -47.27 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 123.475 0.71 . . . . 0.0 109.268 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -61.2 -40.25 93.27 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.527 0.731 . . . . 0.0 111.315 -177.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -69.87 -23.33 63.24 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 125.528 1.531 . . . . 0.0 113.894 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.5 m -65.23 113.55 4.08 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 176.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.301 2.1 p -91.07 -174.43 3.98 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.039 2.135 . . . . 0.0 111.746 -176.321 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -81.26 -75.95 0.26 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -175.19 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -95.19 -25.41 16.4 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 -175.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 8.4 m -63.72 149.2 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 O-C-N 120.706 -1.246 . . . . 0.0 108.569 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -103.28 129.44 50.28 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 103.174 -2.899 . . . . 0.0 103.174 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.3 tp -130.0 160.59 33.19 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -130.82 153.34 49.19 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 175.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.473 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -138.8 158.73 43.68 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.466 0.65 . . . . 0.0 110.338 175.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -129.64 123.48 31.33 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 103.88 -2.637 . . . . 0.0 103.88 177.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.3 t -134.53 135.34 53.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -175.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 59.5 ttp85 -80.64 123.63 28.31 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 104.883 -2.266 . . . . 0.0 104.883 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -135.26 123.83 23.57 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.278 1.037 . . . . 0.0 110.248 -175.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 26.8 m . . . . . 0 C--N 1.317 -0.816 0 C-N-CA 124.364 1.066 . . . . 0.0 111.589 -175.527 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.5 m . . . . . 0 N--CA 1.448 -0.543 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -63.21 157.81 21.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.327 0.585 . . . . 0.0 110.706 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.1 mtt-85 -141.86 155.54 45.54 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 105.05 -2.204 . . . . 0.0 105.05 175.192 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 t -144.25 160.85 40.29 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.4 mtpt -145.81 176.47 9.64 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 126.395 1.878 . . . . 0.0 108.795 -175.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -135.68 140.4 44.44 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -121.19 117.82 28.09 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.965 1.706 . . . . 0.0 107.222 -176.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -87.97 113.58 23.76 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 105.091 -2.188 . . . . 0.0 105.091 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.7 mt -104.4 143.2 16.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 -176.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -123.94 123.71 41.01 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 175.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -96.49 123.75 40.26 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 125.766 1.626 . . . . 0.0 106.731 175.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.4 mt -143.4 97.38 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 176.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -60.64 169.73 8.26 Favored Glycine 0 CA--C 1.537 1.431 0 CA-C-N 119.816 1.189 . . . . 0.0 112.101 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -76.96 -12.39 59.94 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 119.991 -1.888 . . . . 0.0 109.978 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -83.15 -29.69 28.45 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 120.207 -1.558 . . . . 0.0 112.511 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.7 125.35 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 CA-C-O 121.586 0.708 . . . . 0.0 111.831 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 18.9 t -64.85 150.27 47.97 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 124.529 1.131 . . . . 0.0 110.681 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.45 -28.01 58.94 Favored Glycine 0 CA--C 1.521 0.448 0 C-N-CA 125.339 1.447 . . . . 0.0 113.913 -178.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.6 tt -59.2 -37.35 77.24 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.116 1.458 . . . . 0.0 110.241 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -73.76 -43.82 57.91 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 121.266 -0.896 . . . . 0.0 109.073 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -57.27 -28.93 63.42 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.847 -0.597 . . . . 0.0 110.359 177.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.74 -44.38 97.01 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 119.599 1.091 . . . . 0.0 109.703 176.025 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.07 -54.98 40.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 118.014 -0.994 . . . . 0.0 108.331 175.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 59.7 m -50.58 -39.63 50.18 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.925 0.89 . . . . 0.0 110.112 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.04 -26.4 74.03 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 118.562 -1.132 . . . . 0.0 113.745 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.1 m -105.07 -0.41 26.72 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.627 1.571 . . . . 0.0 110.981 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -103.96 -24.16 13.27 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 124.809 1.244 . . . . 0.0 110.084 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -52.57 -37.96 58.99 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 119.883 1.22 . . . . 0.0 111.5 175.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.1 t -56.82 -41.68 78.25 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.067 0.849 . . . . 0.0 110.393 175.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 28.4 mt -64.18 -64.74 0.8 Allowed 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 125.871 1.668 . . . . 0.0 109.685 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -57.51 -30.76 37.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 117.852 -1.071 . . . . 0.0 110.257 175.638 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -65.42 -31.35 72.41 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 120.739 1.609 . . . . 0.0 110.468 176.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -63.52 -23.8 67.55 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 121.112 1.778 . . . . 0.0 111.966 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 81.1 t -85.55 -53.82 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 175.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 53.7 t -78.28 25.9 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 128.012 2.525 . . . . 0.0 111.993 -175.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -58.07 -25.65 61.53 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 120.031 -1.668 . . . . 0.0 109.864 175.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.01 67.8 4.8 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.298 1.839 . . . . 0.0 106.688 175.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.12 174.53 11.23 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 121.157 -0.964 . . . . 0.0 111.778 179.084 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -110.27 -47.63 3.27 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.761 0.825 . . . . 0.0 110.868 -176.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.2 mptt -158.7 174.68 14.67 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 128.414 2.686 . . . . 0.0 107.486 175.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -120.19 163.19 18.11 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.081 1.752 . . . . 0.0 109.661 176.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -140.54 156.64 46.25 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 103.744 -2.688 . . . . 0.0 103.744 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.8 t -132.58 127.97 57.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.5 mp -134.07 145.86 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 125.958 1.703 . . . . 0.0 109.21 -175.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 78.3 p -138.9 -5.9 1.48 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 126.664 1.985 . . . . 0.0 114.032 -175.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -141.54 153.94 45.17 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 119.227 0.921 . . . . 0.0 109.542 -176.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -37.94 89.22 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.954 -1.092 . . . . 0.0 111.523 -178.426 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 8.0 mttp -66.05 -31.14 71.85 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 124.745 1.218 . . . . 0.0 110.315 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -77.37 -23.39 50.81 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.448 1.899 . . . . 0.0 110.208 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -82.9 -23.13 33.69 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 127.025 2.13 . . . . 0.0 112.658 -178.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -57.9 123.47 15.92 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.183 0.901 . . . . 0.0 111.728 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.8 -23.98 55.09 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 115.639 1.718 . . . . 0.0 115.639 177.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -61.12 -55.61 30.49 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -174.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -74.58 -26.26 59.81 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 117.632 -1.627 . . . . 0.0 109.662 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 54.0 mt -56.86 -34.66 44.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 124.652 1.181 . . . . 0.0 109.144 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 38.9 mttt -55.79 -55.4 32.86 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 120.172 1.351 . . . . 0.0 110.063 175.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 5.2 t -67.98 -34.91 77.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.501 0.32 . . . . 0.0 110.507 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -63.63 -42.42 98.15 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.227 -0.921 . . . . 0.0 109.236 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 56.4 mt -69.95 -23.52 63.2 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.167 1.387 . . . . 0.0 111.45 175.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -74.89 -51.02 14.93 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 174.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -53.24 -56.73 14.16 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.025 1.33 . . . . 0.0 109.765 175.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.341 0 C-N-CA 123.892 0.877 . . . . 0.0 112.656 178.155 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.48 0 CA-C-O 121.298 0.57 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.828 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.5 m -66.99 165.59 15.31 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 175.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -123.93 -176.13 3.4 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.526 -1.359 . . . . 0.0 111.327 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -143.64 156.62 16.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 124.002 0.921 . . . . 0.0 110.45 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -100.79 85.74 2.95 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 102.587 -3.116 . . . . 0.0 102.587 174.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -65.46 -32.26 73.78 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 117.927 -1.035 . . . . 0.0 111.962 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -67.76 -50.49 56.85 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.847 1.203 . . . . 0.0 109.815 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.03 -45.9 76.06 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -177.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.7 m -72.31 -30.86 65.18 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 118.754 -0.641 . . . . 0.0 111.297 -177.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 51.1 ttm-85 -67.34 -31.99 72.62 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 116.952 -1.499 . . . . 0.0 108.84 175.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.09 -60.0 3.99 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 120.494 1.497 . . . . 0.0 109.744 -178.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.98 -38.86 89.61 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.171 0.442 . . . . 0.0 111.529 -177.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -56.5 -41.69 77.11 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 122.736 0.414 . . . . 0.0 110.219 176.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -62.03 -45.93 91.4 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 124.61 1.164 . . . . 0.0 110.27 -177.122 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.84 -59.8 4.86 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 175.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.543 HG21 HG23 ' A' ' 30' ' ' VAL . 11.5 t -60.96 -26.1 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 CA-C-O 117.93 -1.033 . . . . 0.0 111.236 -176.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.476 ' HG3' HH11 ' A' ' 21' ' ' ARG . 1.7 ttt85 -66.79 -39.47 87.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 119.933 1.242 . . . . 0.0 110.097 175.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -64.92 123.9 20.63 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.0 -29.16 67.04 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.499 1.119 . . . . 0.0 111.111 176.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.17 -10.13 66.53 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 118.135 -1.369 . . . . 0.0 114.177 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.5 t -71.21 135.62 47.62 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 120.292 2.046 . . . . 0.0 108.05 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.01 -25.99 67.97 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.502 175.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.0 t -75.48 123.69 31.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 105.98 -1.859 . . . . 0.0 105.98 175.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.03 -25.12 3.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 C-N-CA 123.125 0.57 . . . . 0.0 110.333 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.1 p-90 -125.33 147.21 49.23 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 119.113 0.869 . . . . 0.0 109.25 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.543 HG23 HG21 ' A' ' 20' ' ' VAL . 5.5 t -139.83 162.96 25.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 128.032 2.533 . . . . 0.0 107.306 178.139 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 80.7 p -128.33 161.55 29.15 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 175.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -133.6 123.69 25.54 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.5 mmtt -94.37 176.41 6.31 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 176.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -118.93 142.9 47.36 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 175.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -137.1 152.48 50.05 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 175.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 32.86 -98.96 0.01 OUTLIER Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.629 2.061 . . . . 0.0 113.646 176.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.29 39.44 3.25 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.058 1.743 . . . . 0.0 110.467 176.043 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -142.08 175.69 9.54 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.508 1.123 . . . . 0.0 111.503 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 32.0 mm -107.31 135.52 45.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 104.729 -2.322 . . . . 0.0 104.729 175.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.4 m -129.47 158.05 74.48 Favored Pre-proline 0 N--CA 1.47 0.532 0 CA-C-O 118.741 -0.647 . . . . 0.0 110.472 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.71 165.4 32.84 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 121.962 1.775 . . . . 0.0 110.355 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -134.16 -157.86 8.35 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 125.485 1.517 . . . . 0.0 110.557 176.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.8 mp0 -59.03 158.44 8.57 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 125.212 1.405 . . . . 0.0 109.398 176.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.401 ' HB3' HG22 ' A' ' 30' ' ' VAL . 3.6 pt20 -156.78 155.59 31.84 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.768 1.227 . . . . 0.0 108.107 -176.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.7 -179.15 40.73 Favored Glycine 0 CA--C 1.527 0.782 0 CA-C-O 121.589 0.549 . . . . 0.0 113.156 -175.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.85 -26.24 11.33 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.101 1.36 . . . . 0.0 112.186 177.038 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -111.77 128.94 56.25 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 -175.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -83.08 -10.61 58.61 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.611 1.964 . . . . 0.0 113.11 -175.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -53.96 -37.98 64.49 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 120.06 1.3 . . . . 0.0 110.572 175.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -69.01 -34.06 74.65 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.413 1.085 . . . . 0.0 111.602 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -58.48 -39.23 79.41 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.559 1.144 . . . . 0.0 109.51 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.9 mm -59.79 -32.55 49.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 123.874 0.87 . . . . 0.0 109.173 -176.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -79.31 -24.05 43.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.034 1.334 . . . . 0.0 112.441 -176.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -80.94 -23.55 38.77 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.634 1.174 . . . . 0.0 112.609 -175.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 79.6 m -79.39 114.47 18.35 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.777 1.231 . . . . 0.0 108.918 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.2 p -130.16 -173.6 3.09 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 122.475 1.131 . . . . 0.0 111.259 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.4 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 9.6 p-10 -40.77 -76.57 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.49 1 C-N-CA 134.673 5.189 . . . . 0.0 117.67 -175.862 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.4 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 17.2 t70 -106.21 -6.46 18.47 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 125.958 1.703 . . . . 0.0 114.077 -175.101 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.8 m -68.69 131.32 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 O-C-N 120.816 -1.177 . . . . 0.0 110.063 -176.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.6 ptt-85 -103.95 123.51 47.3 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 101.216 -3.624 . . . . 0.0 101.216 175.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.6 tp -141.76 163.21 33.53 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 123.619 0.767 . . . . 0.0 110.01 -175.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -131.48 152.12 50.98 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.509 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -142.32 163.75 32.02 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.315 0.579 . . . . 0.0 111.274 176.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -138.06 123.68 19.75 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 105.3 -2.111 . . . . 0.0 105.3 -176.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.0 t -133.72 138.46 50.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -175.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.1 ttp-105 -80.91 114.9 20.11 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 175.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -131.85 133.33 44.53 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.615 1.166 . . . . 0.0 108.986 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 122.232 1.015 . . . . 0.0 111.034 -176.507 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 69.3 m . . . . . 0 N--CA 1.446 -0.652 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.3 mmtm -64.5 167.73 6.71 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.49 1.138 . . . . 0.0 112.82 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.48 148.12 42.25 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 175.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.6 t -146.51 123.92 11.67 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 104.513 -2.403 . . . . 0.0 104.513 175.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.6 mttt -135.93 176.37 8.75 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -175.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -132.31 127.17 35.03 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.037 -176.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.57 117.76 34.84 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.883 1.673 . . . . 0.0 106.82 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -87.11 113.31 22.75 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 104.3 -2.481 . . . . 0.0 104.3 175.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mt -98.23 146.55 7.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 -176.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.2 m -126.03 123.58 38.76 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 103.317 -2.846 . . . . 0.0 103.317 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 25.6 t-105 -103.28 123.46 46.82 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 175.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.437 HD11 HG21 ' A' ' 97' ' ' THR . 13.3 mm -143.03 101.44 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 105.386 -2.079 . . . . 0.0 105.386 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -60.42 154.63 33.85 Favored Glycine 0 CA--C 1.535 1.303 0 N-CA-C 108.329 -1.909 . . . . 0.0 108.329 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -74.57 -3.35 30.51 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 120.342 -1.681 . . . . 0.0 111.177 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -82.95 -36.01 25.52 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 120.833 -1.167 . . . . 0.0 109.248 -175.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -70.91 123.82 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 104.921 -2.252 . . . . 0.0 104.921 175.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.9 t -78.52 171.74 14.68 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 122.759 1.266 . . . . 0.0 113.547 -174.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -46.84 -35.36 7.76 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 129.12 3.248 . . . . 0.0 113.661 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 tt -62.49 -57.38 11.41 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 119.937 1.869 . . . . 0.0 110.719 176.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -66.1 -37.77 86.59 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 121.774 -0.579 . . . . 0.0 109.885 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -61.41 -33.1 73.13 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.832 -0.542 . . . . 0.0 110.012 175.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.4 -28.63 69.92 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 117.952 -1.023 . . . . 0.0 111.156 176.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -63.06 -55.47 25.2 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 175.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.437 HG21 HD11 ' A' ' 85' ' ' ILE . 13.0 m -50.33 -47.28 55.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.769 0.827 . . . . 0.0 109.764 175.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -59.62 -25.73 61.42 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.026 0.822 . . . . 0.0 114.263 178.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 49.5 m -103.12 -9.41 19.71 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 127.82 2.448 . . . . 0.0 111.155 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -104.52 -23.56 13.12 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 127.118 2.167 . . . . 0.0 112.238 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -48.36 -36.67 14.97 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 119.896 1.226 . . . . 0.0 113.061 176.222 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.0 t -59.76 -34.2 72.68 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.828 HD11 ' HB ' ' A' ' 6' ' ' THR . 15.4 mt -68.33 -61.66 1.74 Allowed 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 126.616 1.966 . . . . 0.0 109.963 -176.18 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.2 p -61.84 -30.4 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 117.502 -1.237 . . . . 0.0 108.489 175.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -41.69 99.52 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 120.76 1.618 . . . . 0.0 109.23 175.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -58.91 -25.63 63.58 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.46 1.027 . . . . 0.0 112.806 177.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 29.9 t -86.04 -54.07 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 59.1 t -76.09 21.93 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 C-N-CA 128.753 2.821 . . . . 0.0 112.218 -175.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -48.83 -22.76 0.88 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.862 1.665 . . . . 0.0 115.309 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -107.29 85.21 2.09 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -147.51 175.26 10.98 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.351 1.86 . . . . 0.0 108.524 176.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.14 -60.37 1.62 Allowed 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -175.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.49 173.76 12.01 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.873 1.269 . . . . 0.0 110.325 -178.191 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -126.59 158.62 35.78 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.452 1.101 . . . . 0.0 111.034 175.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -138.53 155.42 48.41 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 104.949 -2.241 . . . . 0.0 104.949 -175.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 46.8 t -128.53 130.11 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 175.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.5 mp -132.65 153.15 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 126.468 1.907 . . . . 0.0 107.099 -176.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.6 p -149.26 -9.85 0.32 Allowed 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.451 1.901 . . . . 0.0 114.443 -175.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -129.9 154.92 46.83 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.211 1.005 . . . . 0.0 110.756 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.58 HH12 ' CD ' ' A' ' 124' ' ' GLU . 0.0 OUTLIER -69.49 -29.75 67.47 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.587 -176.586 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -76.48 -46.59 26.11 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 121.501 1.955 . . . . 0.0 107.096 174.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -55.34 -23.9 26.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.916 2.087 . . . . 0.0 112.258 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -79.66 -22.87 42.98 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.747 1.619 . . . . 0.0 113.709 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.58 ' CD ' HH12 ' A' ' 120' ' ' ARG . 18.8 mt-10 -69.74 129.04 38.5 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 116.031 1.863 . . . . 0.0 116.031 -175.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.473 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 14.2 mm-40 -53.09 -17.47 1.58 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 125.538 1.535 . . . . 0.0 114.849 175.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.426 ' HA ' ' NZ ' ' A' ' 129' ' ' LYS 0.36 15.3 t70 -65.11 -57.95 7.29 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 117.657 -1.617 . . . . 0.0 112.756 -175.605 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -77.69 -26.3 50.14 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 117.949 -1.5 . . . . 0.0 109.907 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.473 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 51.7 mt -56.53 -40.89 71.07 Favored 'Isoleucine or valine' 0 C--N 1.344 0.345 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.426 ' NZ ' ' HA ' ' A' ' 126' ' ' ASP . 28.1 mtmm -52.85 -52.35 57.58 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 119.905 1.229 . . . . 0.0 111.283 176.242 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.2 t -73.79 -24.19 59.8 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.622 -178.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -67.63 -49.75 61.42 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 175.206 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.01 -23.9 62.34 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.29 1.036 . . . . 0.0 111.092 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -67.5 -52.93 33.3 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 174.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -53.73 -48.82 69.27 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.588 1.085 . . . . 0.0 110.103 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.455 0 C-N-CA 124.415 1.086 . . . . 0.0 112.378 -179.391 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.384 0 N-CA-C 105.424 -2.065 . . . . 0.0 105.424 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.708 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.4 m -134.29 165.24 25.58 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.035 1.734 . . . . 0.0 106.412 -175.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -128.03 178.45 6.19 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.115 -0.991 . . . . 0.0 111.006 -175.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.417 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -138.19 151.35 24.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 122.732 0.413 . . . . 0.0 110.095 176.639 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -99.74 77.73 2.08 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 103.076 -2.935 . . . . 0.0 103.076 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -24.13 66.46 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.027 -1.463 . . . . 0.0 110.47 -175.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -66.46 -59.88 3.26 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 120.228 1.377 . . . . 0.0 109.799 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.62 93.15 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.979 0.912 . . . . 0.0 109.853 -178.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.473 ' HB3' HG11 ' A' ' 107' ' ' VAL . 62.5 m -66.78 -36.94 83.58 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.361 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 68.9 ttt-85 -63.7 -35.45 80.61 Favored 'General case' 0 C--N 1.345 0.405 0 CA-C-N 119.11 0.868 . . . . 0.0 109.111 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.47 -50.61 72.49 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.526 0.603 . . . . 0.0 109.965 -175.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.525 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -67.39 -44.88 77.82 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.435 0.294 . . . . 0.0 111.781 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -51.35 -39.3 56.77 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.646 1.178 . . . . 0.0 111.444 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -65.9 -42.41 90.24 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.399 0.68 . . . . 0.0 111.258 -178.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.3 mp -61.95 -54.87 35.77 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 123.428 0.691 . . . . 0.0 109.977 175.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.433 ' CG2' HG23 ' A' ' 30' ' ' VAL . 13.6 t -55.67 -36.18 41.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 122.83 0.452 . . . . 0.0 111.131 178.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -65.69 -38.25 88.74 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.129 176.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -76.2 123.18 25.45 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 120.166 1.348 . . . . 0.0 109.515 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -67.77 -19.53 65.11 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 121.338 -0.851 . . . . 0.0 111.289 175.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.88 -11.23 84.09 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.801 1.191 . . . . 0.0 112.538 176.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.8 t -74.13 143.24 45.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 175.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -72.37 -14.58 61.75 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.475 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.6 t -86.19 136.59 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 126.825 2.05 . . . . 0.0 109.12 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.53 -27.36 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.436 1.094 . . . . 0.0 110.127 175.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -130.91 154.2 48.35 Favored 'General case' 0 C--N 1.343 0.318 0 CA-C-N 119.836 1.198 . . . . 0.0 111.261 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.525 HG21 ' HB1' ' A' ' 16' ' ' ALA . 5.7 t -139.33 160.94 28.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 128.32 2.648 . . . . 0.0 107.542 176.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 45.1 p -122.41 153.7 38.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 175.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -123.29 123.94 41.86 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 175.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -106.46 175.98 5.32 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 105.222 -2.14 . . . . 0.0 105.222 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -115.06 152.41 32.55 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 175.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -147.59 124.2 11.1 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 53.24 -84.51 0.01 OUTLIER Glycine 0 CA--C 1.53 1.02 0 C-N-CA 126.003 1.764 . . . . 0.0 114.857 176.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.8 p -136.07 25.25 3.29 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.988 1.315 . . . . 0.0 112.009 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -145.7 169.81 17.73 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 119.177 0.899 . . . . 0.0 112.229 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.3 mm -96.48 138.38 21.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 104.282 -2.488 . . . . 0.0 104.282 175.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.3 m -130.79 147.89 67.96 Favored Pre-proline 0 CA--C 1.531 0.25 0 C-N-CA 122.822 0.449 . . . . 0.0 110.947 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.73 139.99 34.79 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 121.566 1.511 . . . . 0.0 108.457 175.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -110.67 -147.65 11.31 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 125.506 1.527 . . . . 0.0 109.793 176.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -59.28 160.3 6.72 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 123.763 0.825 . . . . 0.0 111.179 175.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -141.28 166.06 25.82 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 126.137 1.775 . . . . 0.0 108.641 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.27 179.41 41.38 Favored Glycine 0 N--CA 1.452 -0.291 0 O-C-N 121.593 -0.692 . . . . 0.0 113.033 -175.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -124.14 -12.8 7.37 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 125.559 1.544 . . . . 0.0 113.476 -175.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -131.98 144.82 51.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -83.5 -9.04 59.22 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.429 0.691 . . . . 0.0 110.518 -174.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -58.31 -37.02 74.24 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.327 -1.483 . . . . 0.0 110.219 175.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 19.4 m80 -76.04 -29.34 58.03 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.261 1.024 . . . . 0.0 110.549 175.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -60.51 -32.87 71.87 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 121.565 -0.71 . . . . 0.0 111.994 178.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.5 mm -57.6 -35.62 51.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.4 mm-40 -71.87 -23.57 61.53 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.287 1.435 . . . . 0.0 112.345 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -65.03 -34.62 78.87 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 120.842 -1.161 . . . . 0.0 110.688 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.63 112.86 19.21 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 -176.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.3 p -113.82 172.53 6.92 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.753 1.621 . . . . 0.0 112.66 -175.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -46.38 -71.36 0.07 Allowed 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 118.267 2.691 . . . . 0.0 118.267 -174.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -106.58 -31.34 8.54 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -175.037 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.8 m -70.88 153.3 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.95 0 O-C-N 120.991 -1.068 . . . . 0.0 110.896 -175.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.87 148.16 26.47 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 175.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.3 tp -145.93 162.98 36.55 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.478 1.111 . . . . 0.0 109.495 -175.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -128.16 152.51 47.95 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.429 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.96 143.89 29.78 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 118.34 0.518 . . . . 0.0 112.137 176.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -109.88 123.73 50.1 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 176.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.5 t -133.02 138.99 50.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 122.72 0.408 . . . . 0.0 111.564 -175.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -79.95 120.5 24.24 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 104.187 -2.523 . . . . 0.0 104.187 175.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -135.92 164.2 28.49 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 86.0 m . . . . . 0 N--CA 1.45 -0.451 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 -176.234 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.9 m . . . . . 0 N--CA 1.448 -0.555 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.5 mmpm? -77.23 175.56 9.58 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 119.828 -1.795 . . . . 0.0 110.188 175.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -136.72 161.28 36.37 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.169 0.987 . . . . 0.0 108.712 -175.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.8 t -144.58 123.75 12.92 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 175.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mtpt -132.06 123.39 27.13 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 -175.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -86.06 129.39 34.86 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.088 -175.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -104.04 126.02 50.84 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -94.78 113.31 25.06 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 102.759 -3.052 . . . . 0.0 102.759 175.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.8 mp -95.13 143.53 11.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.2 m -125.42 123.22 38.8 Favored 'General case' 0 N--CA 1.435 -1.203 0 N-CA-C 102.66 -3.089 . . . . 0.0 102.66 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -99.67 124.52 44.98 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 104.039 -2.578 . . . . 0.0 104.039 175.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.538 HD11 HG21 ' A' ' 97' ' ' THR . 5.2 mt -139.2 78.62 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 178.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -42.75 137.53 3.39 Favored Glycine 0 C--N 1.339 0.725 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -176.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -62.19 -4.07 1.58 Allowed 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 118.369 1.085 . . . . 0.0 112.485 -175.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -83.12 -35.98 25.17 Favored 'General case' 0 CA--C 1.521 -0.153 0 O-C-N 120.402 -1.437 . . . . 0.0 109.889 178.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.9 p -78.35 123.73 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 119.889 1.222 . . . . 0.0 109.084 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.3 t -146.05 123.63 11.78 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 175.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 133.26 -151.11 19.99 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 124.254 0.931 . . . . 0.0 111.084 -175.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -50.4 -38.5 43.23 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 126.193 1.797 . . . . 0.0 111.656 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -61.38 -38.11 85.83 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.169 1.35 . . . . 0.0 111.484 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.0 ttm180 -71.47 -37.29 71.34 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.751 1.16 . . . . 0.0 108.322 175.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.48 -31.57 72.77 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 118.788 -0.625 . . . . 0.0 111.849 178.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -59.51 -54.27 48.47 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 119.457 1.026 . . . . 0.0 108.394 176.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.538 HG21 HD11 ' A' ' 85' ' ' ILE . 15.8 m -52.16 -40.97 62.18 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.573 0.624 . . . . 0.0 110.367 175.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -58.77 -25.83 59.45 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-O 119.736 -0.48 . . . . 0.0 113.768 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 50.8 m -115.16 -0.29 13.33 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.568 1.184 . . . . 0.0 111.657 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -103.49 -23.14 13.54 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.71 1.604 . . . . 0.0 108.775 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -53.33 -24.43 11.87 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 120.111 1.323 . . . . 0.0 110.437 174.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -64.09 -41.99 97.09 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.246 -0.909 . . . . 0.0 110.639 176.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.708 HD11 ' HB ' ' A' ' 6' ' ' THR . 12.4 mt -62.82 -62.23 1.87 Allowed 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 125.363 1.465 . . . . 0.0 109.007 -176.057 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.257 0.9 OUTLIER -57.45 -31.32 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 117.501 -1.237 . . . . 0.0 110.702 176.353 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -60.92 -47.58 85.74 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 121.195 1.816 . . . . 0.0 109.8 175.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -54.37 -24.01 17.88 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.089 0.956 . . . . 0.0 111.539 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.473 HG11 ' HB3' ' A' ' 13' ' ' CYS . 61.5 t -86.15 -65.38 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.653 1.181 . . . . 0.0 108.036 175.237 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 98.1 t -64.8 25.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.814 1 C-N-CA 131.957 4.103 . . . . 0.0 113.747 -175.318 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -49.42 -26.6 3.39 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 115.553 1.686 . . . . 0.0 115.553 -175.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -105.49 84.44 2.09 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -138.13 176.52 8.63 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 124.787 1.235 . . . . 0.0 108.293 176.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -104.65 -62.38 1.34 Allowed 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.31 0.644 . . . . 0.0 109.869 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -156.45 175.79 13.55 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 127.554 2.342 . . . . 0.0 106.879 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -117.31 170.58 8.59 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 125.024 1.33 . . . . 0.0 111.077 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -141.67 150.54 42.03 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 105.187 -2.153 . . . . 0.0 105.187 -176.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 65.2 t -124.27 128.7 73.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 175.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.4 mp -129.13 142.15 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 125.562 1.545 . . . . 0.0 107.182 -178.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.6 p -135.13 -3.26 2.48 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 175.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -130.85 149.7 52.36 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.094 1.758 . . . . 0.0 109.652 -175.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 14.0 ttp85 -69.46 -30.64 68.58 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.608 -0.71 . . . . 0.0 111.125 -176.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -73.47 -39.01 65.24 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 120.232 1.378 . . . . 0.0 109.095 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -63.86 -23.7 67.46 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.127 0.971 . . . . 0.0 110.35 175.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -71.93 -22.35 61.48 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.741 -1.224 . . . . 0.0 112.571 176.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -61.28 123.81 18.8 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -176.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.407 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 2.9 mm-40 -56.12 -31.59 63.45 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.232 1.013 . . . . 0.0 113.462 175.791 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -55.48 -43.28 75.39 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -175.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -94.9 -25.87 16.39 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 119.82 1.191 . . . . 0.0 109.473 176.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.407 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 14.9 mt -51.98 -39.7 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 124.782 1.233 . . . . 0.0 107.995 176.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -51.46 -52.29 47.7 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.764 0.711 . . . . 0.0 110.64 175.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -68.23 -40.62 81.99 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.38 0.536 . . . . 0.0 110.583 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -61.47 -39.21 90.06 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.315 -0.866 . . . . 0.0 111.263 178.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.4 mt -73.08 -40.42 65.03 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.767 1.227 . . . . 0.0 110.314 176.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -56.8 -44.54 82.04 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 175.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.75 -49.23 77.24 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.339 1.055 . . . . 0.0 109.208 175.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -177.959 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.396 0 N-CA-C 104.194 -2.521 . . . . 0.0 104.194 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.71 ' HB ' HD11 ' A' ' 103' ' ' LEU . 10.0 m -134.17 178.47 6.94 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.081 1.352 . . . . 0.0 108.328 -175.288 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.3 tttp -127.35 175.45 8.18 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.197 -0.94 . . . . 0.0 111.58 -175.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -139.97 148.2 23.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 C-N-CA 125.993 1.717 . . . . 0.0 107.851 175.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -91.57 79.47 5.48 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 103.478 -2.786 . . . . 0.0 103.478 175.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -60.64 -23.47 64.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 116.92 -1.514 . . . . 0.0 113.577 -175.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.33 -56.79 4.31 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.813 1.642 . . . . 0.0 109.309 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.43 89.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 119.727 -0.178 . . . . 0.0 111.473 -175.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 100.0 m -72.08 -33.85 68.22 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.474 -0.766 . . . . 0.0 111.082 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -24.89 66.52 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 117.856 -1.069 . . . . 0.0 110.704 176.133 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.68 -59.07 5.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 120.387 1.449 . . . . 0.0 110.146 176.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.34 -39.01 91.7 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.651 -0.656 . . . . 0.0 111.216 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -55.92 -47.11 78.08 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 118.438 -0.792 . . . . 0.0 109.532 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -54.67 -47.15 73.96 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 124.971 1.308 . . . . 0.0 110.351 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.3 mp -60.11 -53.97 51.48 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 118.465 0.575 . . . . 0.0 111.088 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 40.4 t -65.02 -24.28 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 O-C-N 121.19 -0.944 . . . . 0.0 111.352 -178.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -51.59 10.48 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 125.321 1.448 . . . . 0.0 110.719 176.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.68 123.71 21.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.693 0.679 . . . . 0.0 112.442 -175.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -67.84 -9.17 42.26 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.874 0.87 . . . . 0.0 113.101 -176.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -91.43 -0.57 72.96 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 119.438 1.017 . . . . 0.0 112.491 176.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.5 t -80.79 145.46 31.45 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 119.055 1.428 . . . . 0.0 111.029 178.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -80.47 -35.84 34.26 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.233 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.0 127.81 27.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 C-N-CA 125.669 1.587 . . . . 0.0 108.264 176.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -115.75 -23.87 3.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 125.002 1.321 . . . . 0.0 110.991 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -124.98 143.34 50.94 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.594 1.158 . . . . 0.0 108.836 -177.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.7 t -137.16 165.25 28.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 127.647 2.379 . . . . 0.0 109.44 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 82.8 p -132.9 156.33 47.42 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.725 1.21 . . . . 0.0 108.125 175.274 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -128.43 124.47 36.32 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 176.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -99.88 176.32 5.48 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -115.85 145.1 43.15 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 104.939 -2.245 . . . . 0.0 104.939 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -133.58 123.52 25.26 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.218 -2.512 . . . . 0.0 104.218 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 36.48 -96.96 0.01 OUTLIER Glycine 0 CA--C 1.533 1.167 0 C-N-CA 126.469 1.985 . . . . 0.0 113.22 -175.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 p -120.18 35.34 4.89 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.681 1.592 . . . . 0.0 113.197 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -146.49 168.74 20.45 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.31 1.044 . . . . 0.0 111.239 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.2 mm -100.14 138.49 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 175.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.7 m -134.08 161.43 63.79 Favored Pre-proline 0 N--CA 1.473 0.706 0 C-N-CA 123.587 0.755 . . . . 0.0 111.688 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.96 155.93 66.94 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 121.896 1.73 . . . . 0.0 108.469 175.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.02 -144.98 7.13 Favored Glycine 0 CA--C 1.52 0.388 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 176.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -68.97 159.64 32.37 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 175.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -141.11 161.84 36.91 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 125.552 1.541 . . . . 0.0 107.349 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.49 -178.21 46.93 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-O 122.393 0.996 . . . . 0.0 113.155 176.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.97 -26.43 4.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.002 1.321 . . . . 0.0 110.313 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -94.9 123.26 38.26 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -83.12 -14.27 53.95 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.201 0.6 . . . . 0.0 110.599 -176.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -57.74 -38.06 74.67 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.561 -1.337 . . . . 0.0 110.065 175.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -68.68 -32.31 72.04 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.645 -0.659 . . . . 0.0 111.575 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -57.98 -31.92 67.38 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.479 1.112 . . . . 0.0 111.025 178.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 mm -63.97 -47.65 89.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -67.78 -23.62 65.23 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.897 0.879 . . . . 0.0 112.799 176.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -67.8 -25.86 65.8 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 119.975 1.261 . . . . 0.0 111.644 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 74.3 m -73.79 112.89 10.34 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.384 0.611 . . . . 0.0 109.654 -175.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.37 2.1 p -105.23 167.28 9.83 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 127.298 2.239 . . . . 0.0 111.437 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -54.12 -76.68 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 -174.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -100.76 -28.25 12.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 119.685 1.129 . . . . 0.0 113.574 -174.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.0 m -58.77 137.71 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 O-C-N 121.276 -0.89 . . . . 0.0 109.619 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.11 134.9 47.45 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 105.09 -2.189 . . . . 0.0 105.09 175.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.8 tp -130.19 161.99 29.9 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 124.684 1.194 . . . . 0.0 109.801 -175.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.411 ' CE2' HG11 ' A' ' 104' ' ' VAL . 11.6 m-85 -120.52 140.83 50.88 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -130.44 146.16 51.95 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 124.01 0.924 . . . . 0.0 108.856 176.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -123.74 123.62 40.91 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 103.562 -2.755 . . . . 0.0 103.562 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 t -138.07 146.61 26.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 118.917 0.781 . . . . 0.0 110.414 -175.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 20.2 ttm180 -79.69 123.99 28.16 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -128.82 170.75 12.99 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.917 1.287 . . . . 0.0 109.183 176.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 90.6 m . . . . . 0 N--CA 1.451 -0.391 0 C-N-CA 125.106 1.362 . . . . 0.0 107.864 -176.245 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -71.12 175.91 4.87 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 122.36 1.076 . . . . 0.0 108.937 175.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -132.52 150.21 52.19 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 175.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.1 t -125.12 128.92 49.18 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 103.511 -2.774 . . . . 0.0 103.511 175.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -136.08 123.91 22.6 Favored 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -177.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -91.6 128.11 37.3 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.589 -175.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -103.62 121.57 43.2 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 -176.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.79 113.37 23.39 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 105.048 -2.205 . . . . 0.0 105.048 175.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.0 mp -96.15 138.86 20.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 176.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -122.68 123.29 40.79 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 104.269 -2.493 . . . . 0.0 104.269 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 63.8 t-105 -92.13 123.33 35.4 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 104.224 -2.51 . . . . 0.0 104.224 175.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.463 HD11 HG21 ' A' ' 97' ' ' THR . 6.0 mt -150.16 92.06 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 176.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -57.63 174.97 2.01 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 123.933 0.778 . . . . 0.0 113.183 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -86.51 -9.24 56.59 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.47 -1.018 . . . . 0.0 110.67 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -83.86 -31.74 25.61 Favored 'General case' 0 C--O 1.238 0.475 0 O-C-N 121.022 -1.049 . . . . 0.0 109.142 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -65.7 146.39 13.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 118.73 0.695 . . . . 0.0 110.739 -177.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 39.9 t -74.62 151.78 39.31 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 125.602 1.561 . . . . 0.0 110.812 -177.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.2 -28.87 69.82 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 123.907 0.765 . . . . 0.0 111.469 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.2 tt -62.39 -47.96 81.81 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 118.284 1.042 . . . . 0.0 109.653 176.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -65.46 -46.47 79.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.697 -0.668 . . . . 0.0 109.853 175.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.01 -27.9 61.99 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.45 1.023 . . . . 0.0 111.82 177.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.64 -36.68 85.03 Favored 'General case' 0 C--O 1.234 0.272 0 O-C-N 120.7 -1.25 . . . . 0.0 112.104 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -57.02 -46.42 82.37 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 118.641 -0.695 . . . . 0.0 109.515 176.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.463 HG21 HD11 ' A' ' 85' ' ' ILE . 7.2 m -55.38 -42.46 74.0 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 123.66 0.784 . . . . 0.0 109.781 -177.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -70.66 -26.35 74.21 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 119.195 0.907 . . . . 0.0 113.135 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 86.0 m -86.05 -15.95 39.67 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.768 1.227 . . . . 0.0 111.419 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -103.5 -23.73 13.49 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 127.458 2.303 . . . . 0.0 113.225 -175.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -50.0 -27.91 6.16 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.29 1.405 . . . . 0.0 113.004 176.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.2 t -62.88 -38.64 91.68 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.499 1.045 . . . . 0.0 112.072 176.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.71 HD11 ' HB ' ' A' ' 6' ' ' THR . 12.4 mt -65.17 -61.33 2.2 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 125.419 1.488 . . . . 0.0 109.658 -176.363 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 104' ' ' VAL 0.257 0.8 OUTLIER -58.63 -28.96 38.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-O 118.117 -0.944 . . . . 0.0 109.262 175.636 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.01 -39.52 94.3 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 120.534 1.515 . . . . 0.0 109.653 175.503 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -54.52 -32.37 58.01 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 120.19 1.359 . . . . 0.0 112.988 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 52.5 t -86.44 -60.01 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 125.123 1.369 . . . . 0.0 111.022 176.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 3.5 t -74.32 26.62 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 129.193 2.997 . . . . 0.0 113.545 -175.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -53.61 -13.58 0.68 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 120.183 -1.573 . . . . 0.0 114.169 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -94.99 29.43 2.41 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.113 1.324 . . . . 0.0 113.08 175.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.37 174.12 9.32 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 175.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -123.69 -45.62 2.03 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.672 -0.642 . . . . 0.0 110.974 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.72 175.6 8.67 Favored 'General case' 0 C--O 1.235 0.29 1 C-N-CA 131.842 4.057 . . . . 0.0 106.333 175.811 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -132.1 171.4 13.68 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.82 0.848 . . . . 0.0 111.267 -178.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -146.85 149.98 34.35 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 40.3 t -123.62 124.22 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 175.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.7 mt -122.12 146.01 27.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 125.701 1.6 . . . . 0.0 109.521 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 12.8 p -140.08 -8.45 1.18 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.493 1.294 . . . . 0.0 114.493 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -137.41 154.4 49.97 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.743 1.156 . . . . 0.0 109.32 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 29.1 ttp-105 -50.6 -46.53 58.01 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 124.165 0.986 . . . . 0.0 110.733 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -63.45 -38.19 90.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 118.587 0.63 . . . . 0.0 110.295 -176.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -72.62 -23.92 61.0 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.81 1.244 . . . . 0.0 110.491 177.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -79.57 -23.72 42.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.923 1.689 . . . . 0.0 111.527 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -69.77 123.56 21.74 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.099 1.318 . . . . 0.0 110.543 -176.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.1 -13.87 14.03 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.813 1.245 . . . . 0.0 113.717 -178.09 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -56.09 -65.93 0.52 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.363 1.865 . . . . 0.0 112.802 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -77.34 -25.86 51.49 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 118.263 -1.375 . . . . 0.0 108.815 -175.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 19.5 mt -50.21 -41.17 18.46 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 C-N-CA 125.569 1.548 . . . . 0.0 108.444 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 33.4 mttp -55.95 -56.33 21.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.582 -0.723 . . . . 0.0 111.054 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 43.4 t -67.76 -33.27 74.53 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.613 1.097 . . . . 0.0 110.754 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -60.86 -52.79 63.56 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.583 1.083 . . . . 0.0 109.791 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.8 mt -59.87 -41.05 90.67 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 124.656 1.183 . . . . 0.0 111.125 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -62.55 -52.58 62.87 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 123.645 0.778 . . . . 0.0 110.804 176.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -61.61 -45.84 92.35 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 119.331 0.969 . . . . 0.0 109.182 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.444 0 C-N-CA 124.508 1.123 . . . . 0.0 111.693 175.602 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.216 0 CA-C-O 123.195 1.474 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.654 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.7 m -89.85 162.51 15.44 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 125.522 1.529 . . . . 0.0 107.868 176.301 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -133.45 -172.01 2.85 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 120.962 -1.086 . . . . 0.0 111.202 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.18 151.78 29.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 125.409 1.484 . . . . 0.0 108.964 175.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -86.7 79.0 9.0 Favored 'General case' 0 N--CA 1.464 0.272 1 N-CA-C 99.399 -4.297 . . . . 0.0 99.399 174.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.9 pttm -54.05 -35.4 61.97 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -74.49 -44.03 53.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 119.372 0.987 . . . . 0.0 109.469 -175.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.67 -45.86 73.99 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 118.13 0.423 . . . . 0.0 111.537 176.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 84.8 m -69.88 -41.6 74.56 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 119.382 -0.342 . . . . 0.0 110.574 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 -64.39 -32.29 73.85 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 116.631 -1.652 . . . . 0.0 109.777 175.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.87 -53.64 52.99 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 120.69 1.586 . . . . 0.0 110.029 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.443 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -56.23 -47.37 78.59 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.976 0.807 . . . . 0.0 110.98 176.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -55.54 -44.04 76.37 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.137 0.426 . . . . 0.0 111.005 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.54 -46.89 88.51 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 125.429 1.492 . . . . 0.0 109.612 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.2 mp -60.72 -46.57 89.88 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.789 0.722 . . . . 0.0 110.163 175.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.75 -39.38 81.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 123.598 0.759 . . . . 0.0 110.301 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -48.55 78.22 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -54.41 135.72 44.91 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 123.024 1.392 . . . . 0.0 113.032 -175.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -86.03 -22.69 27.12 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.679 1.992 . . . . 0.0 110.297 -178.545 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.35 -8.15 86.69 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.005 0.812 . . . . 0.0 112.947 176.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.7 t -81.21 139.62 35.41 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 118.653 1.226 . . . . 0.0 108.815 176.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -76.8 -35.65 57.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.311 0.644 . . . . 0.0 110.206 175.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.3 t -57.07 133.22 21.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 124.174 0.99 . . . . 0.0 108.935 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.09 -24.41 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 123.217 0.607 . . . . 0.0 109.656 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 49.3 p-90 -130.31 145.99 51.84 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 119.897 1.226 . . . . 0.0 110.366 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.443 HG11 ' HB1' ' A' ' 16' ' ' ALA . 49.9 t -137.28 168.42 21.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 175.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.43 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 76.5 p -132.02 161.01 34.23 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 175.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -135.19 123.9 23.77 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.76 -2.311 . . . . 0.0 104.76 -177.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -99.17 175.85 5.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 106.722 -1.585 . . . . 0.0 106.722 -176.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.448 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 24.0 m-85 -119.85 139.19 52.76 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 177.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -140.21 123.16 16.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 47.23 -98.47 0.01 OUTLIER Glycine 0 CA--C 1.526 0.768 0 C-N-CA 125.043 1.306 . . . . 0.0 113.818 -176.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 p -120.6 25.15 9.93 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.86 2.464 . . . . 0.0 111.745 -175.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -149.34 166.27 29.51 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.448 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 36.4 mm -92.88 133.1 35.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 175.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.7 m -126.7 160.95 55.97 Favored Pre-proline 0 N--CA 1.468 0.457 0 C-N-CA 123.406 0.682 . . . . 0.0 110.741 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.21 167.37 26.99 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 121.463 1.442 . . . . 0.0 109.11 175.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -139.23 -140.58 3.97 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.222 1.392 . . . . 0.0 112.13 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -66.86 156.42 35.73 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 126.749 2.02 . . . . 0.0 110.228 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -149.29 158.27 44.03 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 125.02 1.328 . . . . 0.0 110.14 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -173.39 174.68 46.12 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 123.91 0.767 . . . . 0.0 112.672 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.77 -8.9 7.85 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.72 1.608 . . . . 0.0 112.686 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.22 135.1 55.19 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 104.278 -2.49 . . . . 0.0 104.278 177.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.401 ' CE1' ' CD2' ' A' ' 51' ' ' PHE . 41.0 t80 -86.29 -14.67 43.0 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -175.23 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -55.28 -44.86 76.07 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.474 1.488 . . . . 0.0 109.532 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -62.68 -22.97 66.88 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.256 1.022 . . . . 0.0 112.028 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.401 ' CD2' ' CE1' ' A' ' 48' ' ' TYR . 0.7 OUTLIER -62.51 -55.54 26.53 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.766 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.02 -33.52 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.138 0.575 . . . . 0.0 109.815 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -62.49 -48.18 80.7 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -74.17 -22.43 59.42 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 -175.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 86.9 m -51.57 119.97 4.69 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 121.481 1.946 . . . . 0.0 110.727 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 p -101.54 164.18 11.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.458 1.503 . . . . 0.0 113.178 -175.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -49.77 -70.58 0.08 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 130.658 3.583 . . . . 0.0 119.251 -174.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -106.53 -36.49 6.75 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 124.845 1.258 . . . . 0.0 114.217 -175.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.6 m -58.39 145.36 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 CA-C-O 122.432 1.111 . . . . 0.0 110.397 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.72 139.64 38.69 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 175.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.4 tp -141.38 160.0 41.05 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -126.55 123.52 37.9 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 105.057 -2.201 . . . . 0.0 105.057 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.43 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -104.45 162.23 13.42 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 175.775 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -137.25 123.15 20.12 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 102.188 -3.264 . . . . 0.0 102.188 178.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.8 t -129.21 134.52 63.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -175.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 41.2 ttt85 -77.1 113.54 14.94 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 105.115 -2.18 . . . . 0.0 105.115 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -116.64 173.77 6.44 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 126.368 1.867 . . . . 0.0 108.963 -175.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 37.0 m . . . . . 0 C--N 1.327 -0.383 0 O-C-N 121.278 -0.889 . . . . 0.0 109.887 -176.013 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.8 m . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -69.26 167.05 17.14 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -138.44 167.9 20.91 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -177.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.3 t -125.58 158.37 34.8 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 175.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.5 mmmt -144.22 171.78 13.83 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 127.048 2.139 . . . . 0.0 107.475 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -144.53 123.88 13.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.532 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.94 129.24 56.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 126.054 1.742 . . . . 0.0 108.432 -176.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -98.57 113.8 25.99 Favored 'General case' 0 C--O 1.222 -0.342 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 175.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.1 mt -103.63 137.57 31.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 -177.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -116.05 122.89 46.51 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 175.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.0 t-105 -97.04 123.29 40.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 103.833 -2.654 . . . . 0.0 103.833 175.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.1 mt -145.56 98.12 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 176.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -59.94 162.86 16.18 Favored Glycine 0 CA--C 1.53 0.992 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -76.08 -6.41 51.0 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 121.07 -1.253 . . . . 0.0 110.998 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -83.2 -35.98 25.03 Favored 'General case' 0 C--N 1.341 0.231 0 O-C-N 121.423 -0.798 . . . . 0.0 109.589 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.7 p -71.56 127.62 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 176.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 48.3 t -63.32 153.44 34.94 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 124.28 1.032 . . . . 0.0 110.805 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -51.28 -29.94 23.71 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 125.678 1.608 . . . . 0.0 113.054 176.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.95 -51.66 69.11 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.355 1.078 . . . . 0.0 110.232 176.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -70.28 -31.49 68.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 118.51 -0.757 . . . . 0.0 110.036 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -63.41 -28.84 70.25 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.757 1.162 . . . . 0.0 109.273 175.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.89 -24.13 61.91 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.569 1.148 . . . . 0.0 111.958 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.36 -35.4 69.9 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 118.787 0.721 . . . . 0.0 110.481 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.7 m -54.8 -33.35 61.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.345 1.058 . . . . 0.0 110.146 175.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.33 -14.27 61.67 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 125.547 1.546 . . . . 0.0 114.481 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 30.0 m -123.18 -3.87 8.48 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.462 1.631 . . . . 0.0 109.894 175.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -103.79 -37.97 7.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 123.919 0.888 . . . . 0.0 112.684 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.5 mtmp? -57.18 -36.9 71.37 Favored 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 120.257 1.39 . . . . 0.0 111.376 -176.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -56.87 -34.06 67.46 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 120.255 1.388 . . . . 0.0 112.046 177.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.654 HD11 ' HB ' ' A' ' 6' ' ' THR . 39.9 mt -66.21 -65.17 0.71 Allowed 'General case' 0 CA--C 1.508 -0.653 0 C-N-CA 125.887 1.675 . . . . 0.0 109.137 -176.19 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.1 p -57.73 -32.96 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-O 117.846 -1.073 . . . . 0.0 108.519 175.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -67.48 -24.31 65.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 121.144 1.793 . . . . 0.0 111.32 178.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.68 -27.22 66.66 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.92 1.236 . . . . 0.0 110.302 175.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 89.4 t -85.73 -56.68 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 175.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.1 t -70.09 17.35 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 130.17 3.388 . . . . 0.0 112.278 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -57.49 -26.71 61.7 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 119.406 -2.059 . . . . 0.0 111.027 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -94.9 72.35 3.48 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 125.247 1.419 . . . . 0.0 107.521 176.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -143.79 176.21 9.42 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.521 0.728 . . . . 0.0 110.209 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.68 -66.15 0.94 Allowed 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.772 0.829 . . . . 0.0 111.549 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -155.49 176.27 12.81 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.376 2.27 . . . . 0.0 111.778 -175.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -122.95 163.86 19.59 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.975 0.91 . . . . 0.0 111.212 175.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -138.67 147.75 43.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 -175.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.5 t -118.27 123.32 71.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 3.0 mt -132.44 143.27 40.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -176.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 7.7 p -143.24 -0.59 1.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.566 1.146 . . . . 0.0 112.679 -176.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -139.24 157.03 46.63 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.053 1.741 . . . . 0.0 108.846 -175.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -73.54 -41.67 62.68 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.823 -176.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -62.55 -34.37 76.81 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 120.136 1.335 . . . . 0.0 109.429 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -65.48 -23.3 66.87 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.785 1.634 . . . . 0.0 110.768 175.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -86.44 -23.53 26.0 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.657 1.183 . . . . 0.0 113.888 -176.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -57.15 123.84 16.67 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.711 1.204 . . . . 0.0 110.753 -176.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.97 -23.82 66.63 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.529 ' HA ' ' CE ' ' A' ' 129' ' ' LYS 0.356 10.5 t70 -57.69 -52.16 66.59 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 121.454 1.934 . . . . 0.0 113.526 -175.437 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -74.35 -23.15 58.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 116.821 -1.952 . . . . 0.0 109.019 -177.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 56.6 mt -55.78 -41.8 67.43 Favored 'Isoleucine or valine' 0 C--N 1.347 0.473 0 CA-C-N 119.283 0.947 . . . . 0.0 108.519 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.529 ' CE ' ' HA ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -54.73 -51.23 66.29 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 119.91 1.232 . . . . 0.0 111.434 175.588 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.9 t -71.25 -31.39 67.48 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.058 -175.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 36.1 tp10 -63.93 -46.51 84.46 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.612 1.165 . . . . 0.0 108.798 175.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 91.2 mt -66.18 -31.01 71.59 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.555 -0.716 . . . . 0.0 110.412 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? -65.98 -49.13 68.92 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.488 1.04 . . . . 0.0 108.317 175.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 39.9 mtmt -56.46 -45.06 81.04 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.824 0.738 . . . . 0.0 110.117 176.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 125.358 1.463 . . . . 0.0 114.029 176.607 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.16 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.503 ' HB ' HD11 ' A' ' 103' ' ' LEU . 3.2 m -143.05 166.44 24.63 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.065 1.746 . . . . 0.0 106.805 -175.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.5 tttm -130.14 -178.66 4.83 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 124.137 0.975 . . . . 0.0 109.799 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.407 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -135.56 147.81 28.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 176.254 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -89.91 73.06 7.47 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 175.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -31.6 69.84 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-O 118.108 -0.949 . . . . 0.0 109.649 -176.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -63.74 -56.85 12.48 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.26 0.936 . . . . 0.0 109.394 -177.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.18 -43.27 82.6 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 122.27 -0.268 . . . . 0.0 110.846 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 79.9 m -68.91 -28.14 66.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.436 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -61.5 -38.86 88.86 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.527 176.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.44 -56.3 23.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 119.358 0.981 . . . . 0.0 109.771 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.412 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -61.06 -42.93 99.42 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.862 -0.524 . . . . 0.0 111.268 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -53.34 -48.48 68.45 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 175.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -61.56 -47.01 87.45 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 124.93 1.292 . . . . 0.0 110.348 -176.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -63.74 -27.39 69.17 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.422 ' CG2' HG23 ' A' ' 30' ' ' VAL . 6.6 t -83.53 -33.27 9.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 118.889 0.768 . . . . 0.0 109.948 175.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -70.56 -44.69 66.89 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.493 1.917 . . . . 0.0 111.743 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -70.83 123.49 22.1 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.646 1.578 . . . . 0.0 113.162 -175.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -72.21 -11.83 60.9 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.705 0.802 . . . . 0.0 110.217 175.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.74 -26.6 62.47 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 125.514 1.531 . . . . 0.0 111.705 175.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.2 t -85.92 150.24 24.64 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.915 1.686 . . . . 0.0 108.709 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.93 -14.58 44.3 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.215 0.606 . . . . 0.0 111.723 175.433 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.6 t -70.53 133.54 31.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -176.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.31 -24.06 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 118.456 -0.783 . . . . 0.0 111.44 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 55.0 p-90 -131.61 153.15 50.22 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 120.014 1.279 . . . . 0.0 110.83 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.422 HG23 ' CG2' ' A' ' 20' ' ' VAL . 4.7 t -140.86 164.37 21.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 129.663 3.185 . . . . 0.0 109.122 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 39.2 p -128.82 158.56 38.36 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.366 1.466 . . . . 0.0 107.883 175.219 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -133.56 123.69 25.58 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.5 mtpt -99.63 176.9 5.32 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 175.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -117.53 144.13 45.39 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 175.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -142.83 156.47 44.95 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 175.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 35.92 -104.7 0.03 OUTLIER Glycine 0 CA--C 1.53 0.992 0 C-N-CA 125.742 1.639 . . . . 0.0 112.065 -175.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.6 p -129.89 41.96 3.35 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 127.443 2.297 . . . . 0.0 109.456 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.9 t -149.55 172.73 14.54 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.113 0.965 . . . . 0.0 112.349 -175.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.5 mm -99.62 140.03 19.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 175.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.7 m -129.85 156.57 78.76 Favored Pre-proline 0 N--CA 1.469 0.514 0 C-N-CA 123.436 0.694 . . . . 0.0 110.551 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -71.46 154.35 60.57 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.812 1.674 . . . . 0.0 109.98 175.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -126.28 -158.21 9.82 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 125.738 1.637 . . . . 0.0 109.703 176.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -53.17 157.55 1.83 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 126.607 1.963 . . . . 0.0 111.468 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.2 pm0 -144.57 169.86 17.17 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.269 1.428 . . . . 0.0 109.885 177.037 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -172.61 166.47 39.16 Favored Glycine 0 CA--C 1.522 0.48 0 CA-C-O 122.222 0.901 . . . . 0.0 112.76 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -99.23 -18.51 17.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.239 1.416 . . . . 0.0 110.548 175.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 49' ' ' GLN . 4.9 tp10 -129.2 139.02 52.03 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 176.034 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.419 ' CE1' ' CD2' ' A' ' 51' ' ' PHE . 53.8 t80 -83.82 -5.18 59.15 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.633 1.973 . . . . 0.0 113.077 -175.117 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.42 ' H ' ' HG3' ' A' ' 47' ' ' GLU . 18.2 tt0 -57.72 -36.85 72.58 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 120.62 -1.3 . . . . 0.0 110.958 176.034 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -65.77 -39.9 91.49 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.943 0.897 . . . . 0.0 110.504 176.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.419 ' CD2' ' CE1' ' A' ' 48' ' ' TYR . 33.2 t80 -56.97 -34.94 68.57 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 125.223 1.409 . . . . 0.0 112.029 -176.02 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 mm -60.03 -35.75 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 24.8 mm100 -85.86 -24.15 26.81 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.429 1.492 . . . . 0.0 112.457 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -67.48 -24.66 65.62 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 118.942 0.792 . . . . 0.0 111.467 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 78.0 m -75.21 113.42 12.54 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.311 2.1 p -92.89 171.23 9.1 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.595 1.558 . . . . 0.0 112.667 -175.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -47.21 -74.65 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 118.118 2.636 . . . . 0.0 118.118 -174.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -107.51 -35.62 6.7 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 127.323 2.249 . . . . 0.0 115.965 -174.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.4 m -54.93 155.53 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 N-CA-C 114.714 1.376 . . . . 0.0 114.714 -175.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 26.7 ptt-85 -103.99 135.32 45.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.6 tp -142.74 165.71 26.64 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 125.989 1.716 . . . . 0.0 107.249 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -131.41 154.55 48.53 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.488 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -136.45 151.97 50.07 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 123.581 0.752 . . . . 0.0 111.222 176.084 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -123.46 123.57 40.95 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 104.191 -2.522 . . . . 0.0 104.191 175.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.9 t -130.36 139.27 51.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 122.866 0.467 . . . . 0.0 109.879 -175.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -86.8 126.61 34.73 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 106.179 -1.785 . . . . 0.0 106.179 175.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -136.11 168.36 19.52 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -175.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.327 -0.398 0 O-C-N 120.717 -1.239 . . . . 0.0 108.066 175.779 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.445 -0.68 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -67.13 165.45 15.92 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -133.31 153.96 51.12 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 105.667 -1.975 . . . . 0.0 105.667 175.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 t -129.59 123.93 32.53 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 176.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 49.5 mttt -132.49 145.54 51.25 Favored 'General case' 0 CA--C 1.503 -0.864 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -114.65 144.68 43.04 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.439 -0.8 . . . . 0.0 108.981 -175.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -116.24 121.22 41.4 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 -178.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -91.02 113.36 25.6 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 102.251 -3.24 . . . . 0.0 102.251 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -103.05 143.93 14.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -122.43 123.53 41.53 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 104.737 -2.32 . . . . 0.0 104.737 175.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.8 t-105 -100.78 124.03 45.83 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 104.033 -2.58 . . . . 0.0 104.033 175.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.2 mm -127.12 98.62 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 175.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -44.22 126.85 6.38 Favored Glycine 0 C--N 1.342 0.867 0 N-CA-C 107.008 -2.437 . . . . 0.0 107.008 176.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -54.5 -7.64 0.17 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 -175.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -83.56 -35.87 24.41 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.755 1.622 . . . . 0.0 112.454 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.4 p -75.07 135.75 26.58 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 CA-C-N 121.029 1.74 . . . . 0.0 111.62 -175.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.0 t -146.4 176.7 9.59 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.821 1.248 . . . . 0.0 108.909 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 81.05 -142.58 23.37 Favored Glycine 0 CA--C 1.521 0.443 0 O-C-N 121.654 -0.654 . . . . 0.0 113.062 175.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 9.2 tt -53.18 -44.66 68.09 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 124.791 1.237 . . . . 0.0 110.578 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -60.83 -35.55 76.82 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.115 0.566 . . . . 0.0 110.953 -177.271 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.8 ttt-85 -70.7 -44.56 66.7 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.209 -0.932 . . . . 0.0 108.542 175.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.69 68.87 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.184 0.594 . . . . 0.0 112.444 177.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -58.62 -54.71 44.0 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 175.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.0 m -51.7 -45.67 63.59 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 119.513 1.051 . . . . 0.0 109.974 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -60.4 -25.88 63.43 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-O 119.91 -0.383 . . . . 0.0 113.729 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.8 m -101.4 -9.83 20.77 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.058 1.743 . . . . 0.0 111.232 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -103.84 -23.81 13.36 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 126.134 1.773 . . . . 0.0 112.462 -175.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 42.1 mtpt -54.25 -31.84 54.53 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.466 1.484 . . . . 0.0 112.035 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 5.4 t -66.84 -29.4 69.31 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.288 0.949 . . . . 0.0 112.226 175.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.503 HD11 ' HB ' ' A' ' 6' ' ' THR . 10.7 mt -68.21 -63.55 1.04 Allowed 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 125.169 1.388 . . . . 0.0 108.758 -176.21 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.36 -29.02 41.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 118.04 -0.981 . . . . 0.0 108.741 175.586 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.6 tttp -65.82 -27.34 68.18 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 120.87 1.668 . . . . 0.0 110.72 175.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -65.02 -27.51 68.86 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 121.224 1.829 . . . . 0.0 111.107 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 72.8 t -85.71 -48.87 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 175.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 65.6 t -84.46 26.07 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 128.796 2.838 . . . . 0.0 111.15 -175.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -56.93 -26.32 59.23 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 121.246 1.839 . . . . 0.0 110.942 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -90.08 80.66 6.3 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.954 1.702 . . . . 0.0 106.867 175.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -148.6 176.31 10.44 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 175.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.42 -64.69 1.26 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.899 0.88 . . . . 0.0 111.789 -175.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -132.03 172.32 12.51 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.353 1.461 . . . . 0.0 110.366 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -125.89 164.54 20.52 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.757 1.223 . . . . 0.0 108.234 175.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -150.96 146.07 26.01 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 103.831 -2.655 . . . . 0.0 103.831 -175.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.7 t -122.98 123.82 68.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 3.3 mt -129.41 150.82 34.99 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 125.459 1.504 . . . . 0.0 108.76 -175.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.0 p -151.27 0.34 0.38 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.34 1.056 . . . . 0.0 113.804 177.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.455 ' OD1' ' HE2' ' A' ' 121' ' ' LYS . 5.0 t70 -126.03 145.87 50.13 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.15 1.38 . . . . 0.0 108.906 -175.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 45.4 ttt85 -65.46 -33.93 77.08 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.455 ' HE2' ' OD1' ' A' ' 119' ' ' ASP . 7.4 mtmm -68.78 -45.64 70.8 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 120.125 1.33 . . . . 0.0 108.169 175.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.02 -23.77 62.25 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.466 1.907 . . . . 0.0 111.596 -179.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -78.16 -22.85 48.09 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.571 1.948 . . . . 0.0 113.782 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -69.99 129.84 40.57 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.562 1.528 . . . . 0.0 113.592 -176.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -57.92 -25.79 61.35 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.082 1.353 . . . . 0.0 113.715 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -53.61 -55.04 29.24 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 123.869 0.868 . . . . 0.0 112.495 -176.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -86.37 -23.86 26.02 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 118.517 -1.273 . . . . 0.0 109.029 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 64.4 mt -55.06 -40.13 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 175.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -52.14 -54.27 32.66 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.977 0.808 . . . . 0.0 110.012 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.4 ' HA ' ' HE3' ' A' ' 133' ' ' LYS . 4.2 t -69.0 -36.03 77.36 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.957 -0.544 . . . . 0.0 111.27 -177.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -64.3 -39.46 93.97 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.991 1.269 . . . . 0.0 110.054 176.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 67.5 mt -69.78 -30.52 68.1 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 120.94 -1.1 . . . . 0.0 110.1 175.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 130' ' ' SER . 8.0 mtmp? -67.25 -45.94 75.22 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 175.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -57.21 -55.78 30.27 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 124.407 1.083 . . . . 0.0 111.811 179.305 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.452 0 CA-C-O 122.023 0.916 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.603 ' HB ' HD11 ' A' ' 103' ' ' LEU . 5.0 m -121.99 176.1 5.97 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.215 1.806 . . . . 0.0 106.575 178.575 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -137.86 -179.22 5.64 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.733 -1.23 . . . . 0.0 113.584 -175.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.23 148.6 32.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 C-N-CA 124.522 1.129 . . . . 0.0 108.891 175.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -94.43 76.73 3.88 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 102.455 -3.165 . . . . 0.0 102.455 175.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.6 ttpt -60.26 -27.22 67.06 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 118.047 -0.978 . . . . 0.0 112.812 -175.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -69.35 -57.96 4.62 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 119.588 1.085 . . . . 0.0 109.927 176.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.96 -40.58 83.18 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.758 0.708 . . . . 0.0 110.982 -178.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.6 m -67.68 -29.84 69.21 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 121.369 -0.832 . . . . 0.0 111.4 -178.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.7 ttt85 -60.65 -33.18 72.43 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-O 117.418 -1.277 . . . . 0.0 109.508 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.63 -51.48 69.23 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 120.126 1.33 . . . . 0.0 110.118 -179.02 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.515 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -60.49 -49.71 76.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 121.913 -0.492 . . . . 0.0 110.835 178.317 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -56.27 -38.92 71.82 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.051 0.54 . . . . 0.0 111.196 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -62.93 -55.88 22.04 Favored 'General case' 0 CA--C 1.522 -0.126 0 C-N-CA 124.854 1.262 . . . . 0.0 110.046 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mp -59.84 -32.17 70.43 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 81.6 t -75.62 -34.55 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-N 118.487 0.585 . . . . 0.0 109.528 176.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -72.33 -42.72 65.07 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 119.271 0.942 . . . . 0.0 111.239 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.64 136.64 57.19 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 126.408 1.883 . . . . 0.0 114.022 -175.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.412 ' CG ' HH22 ' A' ' 66' ' ' ARG . 0.8 OUTLIER -86.27 -21.91 27.1 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.539 1.536 . . . . 0.0 113.049 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.24 -33.07 36.86 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 108.789 -1.725 . . . . 0.0 108.789 175.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 t -66.4 123.72 20.77 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 175.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -78.04 -6.76 55.58 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.144 0.578 . . . . 0.0 111.442 175.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.6 t -70.17 127.42 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 175.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.04 -23.82 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 CA-C-O 118.376 -0.821 . . . . 0.0 109.716 175.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 38.6 p-90 -130.71 140.46 50.35 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.737 1.153 . . . . 0.0 110.701 178.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.515 HG11 ' HB1' ' A' ' 16' ' ' ALA . 35.0 t -139.59 152.3 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 175.244 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 37.2 p -103.56 158.8 16.11 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.249 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -127.91 123.97 36.24 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -110.63 176.33 5.08 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -176.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -119.54 140.66 50.17 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 177.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -141.01 136.02 31.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 55.59 -96.35 0.04 OUTLIER Glycine 0 CA--C 1.531 1.045 0 CA-C-N 119.001 0.819 . . . . 0.0 111.654 -178.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.2 p -136.26 28.74 3.08 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.31 1.844 . . . . 0.0 111.333 175.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.8 t -143.92 163.66 32.81 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 -175.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.2 mm -83.67 138.94 18.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.0 m -134.26 159.43 72.33 Favored Pre-proline 0 C--N 1.329 -0.309 0 C-N-CA 124.765 1.226 . . . . 0.0 109.534 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.42 162.08 36.57 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 CA-C-N 120.801 1.322 . . . . 0.0 108.887 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -127.61 -165.0 11.78 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 126.263 1.887 . . . . 0.0 109.832 175.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -56.06 159.27 3.43 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.723 1.209 . . . . 0.0 110.914 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -145.2 168.21 20.94 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.184 1.394 . . . . 0.0 111.843 -175.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.1 -174.62 43.69 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 122.23 0.906 . . . . 0.0 112.328 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.41 -21.06 7.61 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.998 1.719 . . . . 0.0 110.992 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -106.24 117.36 33.83 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.571 1.148 . . . . 0.0 108.695 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -82.79 -16.09 49.17 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.24 0.616 . . . . 0.0 110.151 -177.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -62.57 -27.28 69.07 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 119.545 -1.972 . . . . 0.0 109.964 175.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -76.07 -31.4 58.75 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.74 1.216 . . . . 0.0 111.05 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -57.51 -35.97 70.94 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 125.009 1.323 . . . . 0.0 110.383 178.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.7 mm -58.58 -33.68 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 -176.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -77.78 -24.02 49.0 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.485 1.114 . . . . 0.0 112.213 177.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -72.3 -24.09 61.27 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 119.804 1.184 . . . . 0.0 112.091 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.5 m -65.97 132.97 49.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.772 0.715 . . . . 0.0 109.763 -177.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.256 2.1 p -112.95 163.5 14.59 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.696 1.998 . . . . 0.0 110.622 -176.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -50.05 -76.38 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 130.224 3.41 . . . . 0.0 117.314 -175.284 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -102.67 -36.09 8.45 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 123.669 0.788 . . . . 0.0 112.667 -175.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.4 m -56.73 147.98 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 CA-C-O 122.264 1.03 . . . . 0.0 112.078 -175.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.443 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -103.58 136.42 43.34 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.454 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 41.4 tp -138.19 167.81 21.05 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.918 1.287 . . . . 0.0 108.088 -176.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -132.39 146.97 52.35 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -144.45 124.49 13.59 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 118.39 0.541 . . . . 0.0 109.87 175.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.427 ' CE1' HG13 ' A' ' 108' ' ' VAL . 26.6 t80 -90.31 123.67 34.27 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 175.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.3 t -133.96 140.86 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 121.397 0.617 . . . . 0.0 109.764 -175.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.412 HH22 ' CG ' ' A' ' 23' ' ' ASP . 48.7 ttt180 -84.73 139.0 32.3 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.37 1.468 . . . . 0.0 108.667 175.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -136.2 150.24 48.91 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.159 1.384 . . . . 0.0 108.508 -176.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 99.3 m . . . . . 0 C--N 1.33 -0.268 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.324 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.3 m . . . . . 0 CA--C 1.536 0.417 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -63.3 163.59 10.28 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.852 0.834 . . . . 0.0 109.662 175.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.4 mmt85 -128.29 167.72 16.52 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 126.25 1.82 . . . . 0.0 108.096 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.3 t -133.24 142.48 48.56 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.0 mmtp -141.5 172.15 13.08 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 125.939 1.696 . . . . 0.0 108.002 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -145.55 130.03 17.85 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -177.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.83 119.02 33.61 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.69 113.24 21.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 103.295 -2.854 . . . . 0.0 103.295 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -85.28 132.89 30.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 176.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -116.46 123.28 47.11 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 101.873 -3.38 . . . . 0.0 101.873 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.1 t-105 -102.29 126.87 49.41 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 106.325 -1.732 . . . . 0.0 106.325 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.4 HG21 ' HG3' ' A' ' 94' ' ' ARG . 8.5 mt -138.48 102.0 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 N-CA-C 104.471 -2.418 . . . . 0.0 104.471 175.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.91 125.13 37.87 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 105.992 -2.843 . . . . 0.0 105.992 175.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -55.68 -3.88 0.09 Allowed 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 119.95 1.875 . . . . 0.0 115.003 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 -82.97 -31.35 27.64 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 120.596 -1.315 . . . . 0.0 109.723 177.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.9 p -69.58 136.66 25.75 Favored 'Isoleucine or valine' 0 C--N 1.343 0.31 0 CA-C-N 120.306 1.412 . . . . 0.0 109.588 176.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.3 t -144.04 177.01 8.87 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.306 1.442 . . . . 0.0 108.702 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.02 -145.3 49.63 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 176.143 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.68 -42.32 78.84 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 124.557 1.143 . . . . 0.0 110.901 -176.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -59.83 -43.42 94.57 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 119.215 0.916 . . . . 0.0 110.06 -176.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.4 ' HG3' HG21 ' A' ' 85' ' ' ILE . 12.5 ttp180 -69.64 -44.21 71.07 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.425 -0.797 . . . . 0.0 109.069 175.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.58 -23.47 50.95 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.144 0.978 . . . . 0.0 112.548 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -51.24 -53.82 31.68 Favored 'General case' 0 CA--C 1.504 -0.808 0 CA-C-N 119.772 1.169 . . . . 0.0 108.356 175.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.3 m -57.05 -41.04 77.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.737 0.699 . . . . 0.0 111.558 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.78 -18.78 64.51 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-N 118.161 0.437 . . . . 0.0 112.843 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.6 m -103.41 -17.74 15.12 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.416 1.086 . . . . 0.0 111.677 176.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -103.05 -23.99 13.65 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 117.755 2.502 . . . . 0.0 117.755 -174.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.2 mtmt -50.12 -28.01 6.61 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 122.212 2.278 . . . . 0.0 114.089 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.5 t -62.92 -35.5 80.3 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.119 1.327 . . . . 0.0 111.657 176.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.603 HD11 ' HB ' ' A' ' 6' ' ' THR . 22.6 mt -61.73 -64.54 0.91 Allowed 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 126.554 1.942 . . . . 0.0 109.054 -176.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.409 HG12 ' H ' ' A' ' 104' ' ' VAL . 0.9 OUTLIER -56.92 -32.73 40.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.343 175.87 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -26.34 64.89 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 120.748 1.613 . . . . 0.0 111.793 175.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -64.38 -28.19 69.53 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 120.719 -1.238 . . . . 0.0 110.165 175.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 95.5 t -86.6 -65.59 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 125.338 1.455 . . . . 0.0 108.294 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.427 HG13 ' CE1' ' A' ' 64' ' ' PHE . 19.9 t -67.58 27.4 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.882 1 C-N-CA 132.97 4.508 . . . . 0.0 113.464 -175.687 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -52.63 -26.15 12.81 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.184 -1.573 . . . . 0.0 114.309 -175.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -104.83 95.22 5.73 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -150.66 163.33 38.78 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.298 1.039 . . . . 0.0 108.95 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.81 -66.69 0.58 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.83 163.46 5.01 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 131.493 3.917 . . . . 0.0 105.836 175.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -85.6 173.16 10.36 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 122.521 0.328 . . . . 0.0 111.018 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -129.59 157.45 42.05 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.5 t -116.95 123.81 72.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 175.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mt -132.06 126.71 56.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . 0.382 2.8 p -126.6 1.22 6.85 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 115.848 1.796 . . . . 0.0 115.848 175.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -146.17 158.03 43.86 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.802 0.841 . . . . 0.0 110.358 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -55.49 -42.25 74.14 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.836 175.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.42 -27.56 67.58 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 120.561 1.528 . . . . 0.0 112.612 178.195 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -83.37 -23.97 32.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.518 1.127 . . . . 0.0 110.751 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -75.56 -23.79 56.59 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.014 2.126 . . . . 0.0 113.091 -178.005 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -68.8 123.18 20.24 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -175.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.417 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 4.0 mm-40 -50.69 -32.12 18.41 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 115.973 1.842 . . . . 0.0 115.973 175.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -56.3 -32.31 64.48 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -108.03 -21.54 12.77 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.45 1.023 . . . . 0.0 108.589 175.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.417 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 46.8 mt -56.15 -36.97 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 175.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -58.73 -53.67 55.71 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.771 -0.581 . . . . 0.0 110.345 176.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 9.1 t -64.65 -31.79 73.17 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.135 0.879 . . . . 0.0 111.89 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -65.29 -52.89 51.19 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 124.997 1.319 . . . . 0.0 109.146 176.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 47.3 mt -60.88 -34.72 75.05 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.499 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -62.13 -52.98 61.67 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.194 0.906 . . . . 0.0 108.846 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 26.5 mmtt -54.28 -52.58 60.99 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.413 0.685 . . . . 0.0 110.928 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.278 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -175.979 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.34 0 CA-C-O 121.561 0.696 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.573 ' HB ' HD11 ' A' ' 103' ' ' LEU . 3.4 m -110.38 170.74 7.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.335 1.854 . . . . 0.0 106.07 175.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -125.09 172.71 9.25 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.778 -1.201 . . . . 0.0 110.819 -176.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.419 ' HA ' ' H ' ' A' ' 39' ' ' ILE . 0.1 OUTLIER -142.68 153.4 17.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 C-N-CA 124.582 1.153 . . . . 0.0 109.29 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -94.6 73.37 3.71 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 102.69 -3.078 . . . . 0.0 102.69 175.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 31.4 pttt -58.88 -27.84 65.57 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 117.454 -1.26 . . . . 0.0 111.448 -175.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.2 -56.39 5.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.191 0.997 . . . . 0.0 110.068 -175.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.78 -35.45 77.07 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 121.2 -0.2 . . . . 0.0 110.684 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.0 m -69.46 -34.21 74.05 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 118.534 -0.746 . . . . 0.0 110.363 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 76.0 ttt-85 -60.09 -39.63 86.82 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.846 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.62 -59.0 5.31 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 123.878 0.737 . . . . 0.0 109.489 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.41 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -64.14 -36.7 84.89 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.873 -0.517 . . . . 0.0 112.121 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.417 ' CE1' ' HA ' ' A' ' 108' ' ' VAL . 17.7 t80 -62.2 -28.77 69.91 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.181 0.992 . . . . 0.0 111.207 175.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -74.89 -46.37 36.49 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 124.264 1.025 . . . . 0.0 109.376 175.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.5 mp -57.13 -56.39 22.35 Favored 'General case' 0 C--O 1.221 -0.396 0 O-C-N 121.586 -0.696 . . . . 0.0 110.627 175.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.9 t -59.45 -29.08 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 118.494 0.588 . . . . 0.0 111.13 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -69.94 -45.43 67.49 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 119.992 1.269 . . . . 0.0 111.224 175.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -63.36 123.65 19.25 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.994 1.718 . . . . 0.0 111.311 -175.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -64.81 -27.85 69.16 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.975 1.31 . . . . 0.0 111.992 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.15 -11.31 76.27 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 124.4 1.0 . . . . 0.0 112.669 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -62.08 128.75 37.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 119.046 1.423 . . . . 0.0 108.461 176.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.26 -35.78 82.1 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.8 t -72.5 126.26 32.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 125.42 1.488 . . . . 0.0 108.23 175.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.3 pp -113.72 -23.68 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 124.967 1.307 . . . . 0.0 111.062 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -128.08 145.63 50.94 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.784 0.72 . . . . 0.0 109.975 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.41 HG21 ' HB1' ' A' ' 16' ' ' ALA . 9.5 t -135.83 161.82 37.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 126.482 1.913 . . . . 0.0 107.636 176.621 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.447 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 14.2 p -119.54 159.26 24.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.377 1.071 . . . . 0.0 108.939 175.371 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -137.09 127.8 27.11 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.378 1.471 . . . . 0.0 107.254 -177.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -113.74 176.75 4.9 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 127.074 2.15 . . . . 0.0 107.805 -178.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -118.91 138.22 52.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 175.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -137.48 132.43 33.3 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 59.12 -107.43 1.2 Allowed Glycine 0 CA--C 1.529 0.945 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -175.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.1 p -130.09 29.84 4.87 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.899 1.279 . . . . 0.0 111.704 175.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -130.37 169.1 15.91 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.635 0.652 . . . . 0.0 110.215 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.419 ' H ' ' HA ' ' A' ' 8' ' ' ILE . 38.5 mm -94.98 138.33 21.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 104.21 -2.515 . . . . 0.0 104.21 175.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.3 m -130.81 154.32 81.86 Favored Pre-proline 0 C--N 1.329 -0.309 0 C-N-CA 124.067 0.947 . . . . 0.0 110.326 176.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -75.81 159.66 38.21 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 C-N-CA 121.986 1.791 . . . . 0.0 109.386 175.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -130.62 -162.77 10.8 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 127.201 2.334 . . . . 0.0 108.965 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -58.93 166.92 1.78 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 126.2 1.8 . . . . 0.0 111.723 -176.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.74 171.31 16.44 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 124.749 1.219 . . . . 0.0 111.127 -175.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -171.97 -178.06 41.98 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 123.763 0.697 . . . . 0.0 111.891 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.3 -26.69 7.08 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.871 1.268 . . . . 0.0 111.378 176.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -105.81 130.26 53.82 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 105.672 -1.973 . . . . 0.0 105.672 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.419 ' CE2' ' CD2' ' A' ' 51' ' ' PHE . 21.6 t80 -82.84 -9.47 59.31 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.511 0.724 . . . . 0.0 110.413 -175.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -54.22 -33.73 59.0 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.329 -1.482 . . . . 0.0 110.607 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.4 m80 -68.27 -25.04 64.97 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.305 1.442 . . . . 0.0 112.772 176.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.419 ' CD2' ' CE2' ' A' ' 48' ' ' TYR . 0.6 OUTLIER -62.84 -52.41 63.24 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.158 -0.964 . . . . 0.0 108.842 178.393 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.41 -40.31 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -178.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -61.23 -32.81 72.59 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.172 0.989 . . . . 0.0 112.362 175.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -81.27 -23.59 37.86 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 117.857 -1.068 . . . . 0.0 113.563 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 92.4 m -53.62 114.35 1.5 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 120.183 1.356 . . . . 0.0 111.756 -175.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.25 2.0 p -83.91 164.8 19.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.91 2.084 . . . . 0.0 112.153 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -55.34 -77.12 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 131.153 3.781 . . . . 0.0 120.645 -175.174 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -106.56 -20.79 13.26 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 127.042 2.137 . . . . 0.0 114.673 -174.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.0 m -68.11 168.67 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-O 122.484 1.135 . . . . 0.0 113.388 -175.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.75 123.37 42.51 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 103.109 -2.923 . . . . 0.0 103.109 175.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 42.7 tp -130.65 168.12 17.66 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.864 2.066 . . . . 0.0 109.072 -175.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -132.5 155.45 48.55 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 123.547 0.739 . . . . 0.0 109.679 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -146.23 137.25 24.41 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.272 0.629 . . . . 0.0 110.86 176.069 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -104.91 123.83 48.42 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 105.864 -1.902 . . . . 0.0 105.864 175.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.7 t -133.11 136.52 55.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 -175.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.3 ttp-105 -80.83 134.44 35.78 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -136.1 159.75 40.75 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.835 0.854 . . . . 0.0 108.97 -175.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.7 m . . . . . 0 N--CA 1.454 -0.258 0 O-C-N 120.612 -1.305 . . . . 0.0 109.137 -177.25 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.0 m . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -62.99 157.47 21.81 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -122.15 162.66 20.9 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 -176.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.2 t -138.87 142.13 38.6 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 106.255 -1.757 . . . . 0.0 106.255 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -143.8 173.97 11.22 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 127.271 2.228 . . . . 0.0 106.525 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -146.35 139.04 25.37 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.83 121.39 43.85 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 175.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.96 113.35 25.59 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 101.52 -3.511 . . . . 0.0 101.52 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mp -94.31 144.37 9.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 -178.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -124.05 123.45 40.38 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 103.186 -2.894 . . . . 0.0 103.186 175.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -100.11 128.63 46.16 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 105.129 -2.174 . . . . 0.0 105.129 175.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.0 mt -131.84 103.64 7.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 102.723 -3.065 . . . . 0.0 102.723 175.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -55.42 122.84 28.03 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 106.8 -2.52 . . . . 0.0 106.8 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -55.0 -3.61 0.05 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.561 1.544 . . . . 0.0 114.154 -175.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -83.53 -23.84 31.89 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.692 1.597 . . . . 0.0 110.343 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.9 p -85.87 144.98 8.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-N 120.714 1.597 . . . . 0.0 108.884 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.6 t -146.3 176.56 9.67 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 126.21 1.804 . . . . 0.0 107.41 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 61.04 -146.9 47.55 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 123.312 0.482 . . . . 0.0 113.54 176.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.3 tt -47.11 -51.39 18.0 Favored 'General case' 0 C--N 1.335 -0.029 0 C-N-CA 126.079 1.752 . . . . 0.0 113.504 -175.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.45 -38.36 86.91 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 120.277 1.399 . . . . 0.0 111.174 -178.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.2 ttt180 -65.78 -47.65 74.46 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 175.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.83 -27.02 66.27 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.613 1.165 . . . . 0.0 112.991 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -50.82 -42.53 58.4 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 120.34 1.427 . . . . 0.0 110.281 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.7 m -54.62 -35.6 63.59 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 124.783 1.233 . . . . 0.0 110.256 -177.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.93 -26.33 74.48 Favored Glycine 0 CA--C 1.526 0.77 0 O-C-N 121.499 -0.75 . . . . 0.0 112.817 179.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.8 m -95.39 -8.69 34.9 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.545 1.538 . . . . 0.0 111.016 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -104.22 -29.66 10.68 Favored 'General case' 0 CA--C 1.514 -0.417 0 O-C-N 121.044 -1.035 . . . . 0.0 111.771 -175.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.1 mtpt -52.82 -35.24 56.79 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 118.932 0.787 . . . . 0.0 110.686 176.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.8 t -62.91 -37.64 87.77 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.73 0.695 . . . . 0.0 111.947 176.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.573 HD11 ' HB ' ' A' ' 6' ' ' THR . 7.0 mt -63.43 -60.02 3.92 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 124.388 1.075 . . . . 0.0 109.665 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.85 -30.96 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 117.726 -1.131 . . . . 0.0 109.886 176.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.66 -46.47 88.93 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 120.337 1.426 . . . . 0.0 109.887 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -56.32 -25.07 47.59 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 77.8 t -85.29 -62.51 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.417 ' HA ' ' CE1' ' A' ' 17' ' ' TYR . 21.2 t -68.77 27.25 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.887 1 C-N-CA 131.864 4.065 . . . . 0.0 113.706 -175.454 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -54.12 -26.55 28.03 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 119.789 -1.819 . . . . 0.0 115.098 -175.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -94.87 81.38 3.76 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 175.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -142.04 170.79 15.05 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 125.406 1.482 . . . . 0.0 108.752 176.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -87.55 -66.58 0.9 Allowed 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.71 176.24 12.62 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 128.856 2.863 . . . . 0.0 106.26 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.46 169.39 9.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.827 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -141.04 149.57 41.85 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 103.927 -2.62 . . . . 0.0 103.927 -175.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 48.4 t -121.94 128.67 75.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.7 mt -133.38 148.78 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 125.632 1.573 . . . . 0.0 107.976 -176.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 79.4 p -145.19 1.69 0.97 Allowed 'General case' 0 C--O 1.235 0.29 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -127.2 136.45 52.05 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 125.612 1.565 . . . . 0.0 107.387 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.43 -50.49 40.51 Favored 'General case' 0 CA--C 1.517 -0.302 0 C-N-CA 123.945 0.898 . . . . 0.0 110.683 177.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -33.92 76.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 118.01 0.368 . . . . 0.0 110.504 -175.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -67.51 -23.32 65.45 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.937 1.295 . . . . 0.0 110.781 175.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -85.1 -23.91 28.28 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 125.315 1.446 . . . . 0.0 112.728 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -58.45 123.81 17.46 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.21 0.914 . . . . 0.0 109.671 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.552 ' HB3' ' HE3' ' A' ' 129' ' ' LYS . 27.5 mt-10 -65.35 -19.54 66.0 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 121.35 -0.844 . . . . 0.0 113.274 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -51.98 -51.43 57.31 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.139 0.881 . . . . 0.0 112.779 -175.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -85.62 -24.31 27.18 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.045 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 41.9 mt -56.92 -38.59 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 119.783 1.174 . . . . 0.0 108.376 175.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.552 ' HE3' ' HB3' ' A' ' 125' ' ' GLU . 41.4 mttt -52.94 -50.64 63.63 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.196 0.598 . . . . 0.0 109.783 176.179 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.5 t -66.0 -35.31 80.21 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.184 1.394 . . . . 0.0 112.064 176.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -63.7 -47.88 79.37 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.285 0.948 . . . . 0.0 109.201 176.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.77 -34.34 77.03 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.976 0.91 . . . . 0.0 109.88 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -65.57 -42.89 91.28 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.103 0.865 . . . . 0.0 109.274 175.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? -61.72 -52.83 62.64 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.641 0.776 . . . . 0.0 109.756 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.691 0 C-N-CA 124.202 1.001 . . . . 0.0 112.499 176.045 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.556 0 CA-C-O 121.467 0.651 . . . . 0.0 111.406 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.2 m -134.72 168.78 18.39 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 127.239 2.215 . . . . 0.0 105.797 176.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 45.4 tttm -138.51 172.54 12.73 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 120.642 -1.286 . . . . 0.0 108.836 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.431 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -122.84 149.52 26.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.004 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -83.23 85.03 7.28 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 103.432 -2.803 . . . . 0.0 103.432 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -62.54 -23.72 67.13 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.484 -1.246 . . . . 0.0 113.119 -175.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -79.13 -57.5 3.7 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 119.874 1.215 . . . . 0.0 108.112 179.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.17 -35.61 81.36 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.714 -176.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 82.9 m -80.04 -32.77 39.47 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 119.054 0.843 . . . . 0.0 111.037 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.7 ttt-85 -66.78 -26.86 67.17 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 117.328 -1.32 . . . . 0.0 109.713 175.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.89 -62.46 1.65 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 120.44 1.473 . . . . 0.0 109.441 176.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.428 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -54.79 -47.59 73.8 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.289 0.636 . . . . 0.0 111.431 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -52.15 -46.92 65.61 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 122.44 0.296 . . . . 0.0 110.965 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -64.41 -40.74 96.36 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.1 -0.953 . . . . 0.0 111.35 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.7 mp -60.4 -61.38 2.64 Favored 'General case' 0 C--O 1.221 -0.419 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 175.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.1 t -58.15 -32.96 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 122.806 0.442 . . . . 0.0 111.914 -175.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.85 -26.35 63.23 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 119.234 0.925 . . . . 0.0 110.9 176.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -76.02 127.41 32.9 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 118.986 0.812 . . . . 0.0 110.201 -177.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -61.37 -28.18 69.05 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.808 -0.557 . . . . 0.0 111.113 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.78 1.37 78.82 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.578 1.085 . . . . 0.0 113.627 178.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.8 t -85.98 124.9 32.95 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 120.627 2.213 . . . . 0.0 107.856 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.4 -33.12 71.01 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.9 t -64.73 131.01 30.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 C-N-CA 125.067 1.347 . . . . 0.0 107.389 175.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.3 pp -114.19 -23.62 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.448 1.499 . . . . 0.0 111.037 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.1 p-90 -131.74 146.89 52.41 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 118.814 0.733 . . . . 0.0 111.201 178.024 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.428 HG11 ' HB1' ' A' ' 16' ' ' ALA . 39.9 t -141.46 150.25 19.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 175.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.415 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 38.8 p -103.62 161.74 13.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -130.79 137.96 49.69 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 105.886 -1.894 . . . . 0.0 105.886 175.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -125.61 177.04 6.46 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 126.664 1.985 . . . . 0.0 107.396 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -118.52 137.28 53.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -133.96 123.83 25.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 175.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 58.3 -80.81 0.01 OUTLIER Glycine 0 CA--C 1.529 0.925 0 C-N-CA 126.005 1.764 . . . . 0.0 113.896 176.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.53 10.03 3.71 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.747 2.419 . . . . 0.0 113.664 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -149.82 173.24 13.97 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 120.266 1.394 . . . . 0.0 113.047 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 18.6 mm -84.28 140.03 16.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 175.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.4 m -131.17 160.52 66.63 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 125.482 1.513 . . . . 0.0 110.781 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.55 156.53 36.21 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.497 2.131 . . . . 0.0 109.94 175.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -126.46 -166.83 12.3 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 126.141 1.829 . . . . 0.0 109.532 175.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -54.05 161.67 1.18 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 117.948 0.874 . . . . 0.0 112.891 175.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.79 164.71 29.46 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 127.582 2.353 . . . . 0.0 110.653 -175.571 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -167.03 172.73 42.2 Favored Glycine 0 CA--C 1.525 0.675 0 CA-C-O 121.837 0.687 . . . . 0.0 111.652 176.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -111.93 -2.7 15.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.647 1.179 . . . . 0.0 112.663 -176.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -139.47 150.41 45.14 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -83.6 -9.85 58.64 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.755 0.707 . . . . 0.0 111.875 -175.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -58.49 -39.57 80.38 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 120.597 -1.314 . . . . 0.0 110.252 175.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -76.21 -14.41 60.15 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.986 1.315 . . . . 0.0 112.781 176.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -72.84 -36.8 67.54 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 123.552 0.741 . . . . 0.0 110.147 175.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.7 mm -55.76 -44.97 79.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.31 0.644 . . . . 0.0 109.841 -175.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -61.72 -23.56 66.22 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.358 1.063 . . . . 0.0 113.495 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -70.99 -30.92 67.31 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.628 1.104 . . . . 0.0 112.1 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 56.7 m -72.25 113.58 9.44 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 105.513 -2.032 . . . . 0.0 105.513 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.265 2.5 p -115.31 166.82 11.44 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.646 1.178 . . . . 0.0 113.273 -175.241 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -40.47 -69.45 0.13 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 131.008 3.723 . . . . 0.0 119.286 -174.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -106.05 -36.21 7.01 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.535 1.934 . . . . 0.0 115.974 -174.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 33.7 m -69.06 167.44 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-O 123.244 1.497 . . . . 0.0 114.615 -175.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.66 145.37 38.07 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 103.206 -2.887 . . . . 0.0 103.206 174.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.2 tp -144.33 165.05 29.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 119.869 1.213 . . . . 0.0 107.751 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.456 ' CZ ' HG23 ' A' ' 97' ' ' THR . 5.3 m-85 -130.89 152.58 50.07 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 176.142 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -152.97 135.51 15.18 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 119.037 0.835 . . . . 0.0 112.412 175.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -95.83 123.18 39.3 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 104.906 -2.257 . . . . 0.0 104.906 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 50.3 t -133.87 137.94 51.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -176.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -78.13 138.62 38.81 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -135.99 161.63 35.12 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.842 1.657 . . . . 0.0 107.489 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.3 m . . . . . 0 N--CA 1.452 -0.344 0 O-C-N 120.755 -1.216 . . . . 0.0 108.473 -177.887 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.5 m . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.69 154.09 30.46 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.983 0.897 . . . . 0.0 108.984 -178.156 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -127.73 163.33 24.55 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.519 1.528 . . . . 0.0 108.297 -178.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.6 t -146.35 142.64 28.44 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -138.71 170.2 16.43 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.919 1.688 . . . . 0.0 106.966 176.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -146.38 129.77 16.77 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.8 133.93 49.74 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -99.88 113.21 25.6 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 102.296 -3.224 . . . . 0.0 102.296 175.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.2 mp -91.4 141.31 14.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -123.59 123.21 40.08 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 101.762 -3.422 . . . . 0.0 101.762 175.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.7 t-105 -95.44 123.41 38.96 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 103.84 -2.652 . . . . 0.0 103.84 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.677 HD11 HG21 ' A' ' 97' ' ' THR . 19.8 mt -142.41 85.7 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 102.384 -3.191 . . . . 0.0 102.384 175.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.69 144.48 7.19 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 176.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.9 tm-20 -57.28 -18.56 17.11 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -83.85 -36.23 23.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 124.778 1.231 . . . . 0.0 112.426 -177.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -73.87 123.32 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 107.216 -1.401 . . . . 0.0 107.216 175.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 5.1 t -146.22 176.38 9.79 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.717 1.207 . . . . 0.0 108.942 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 84.47 -148.7 24.13 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.743 -0.598 . . . . 0.0 111.719 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -54.75 -29.9 55.05 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.46 1.104 . . . . 0.0 109.309 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -57.64 -43.57 84.98 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.058 -1.026 . . . . 0.0 110.82 175.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -43.54 74.8 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 175.738 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.05 -31.07 64.8 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.237 0.615 . . . . 0.0 112.115 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -59.4 -61.42 2.64 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 175.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.677 HG21 HD11 ' A' ' 85' ' ' ILE . 96.4 m -53.75 -40.01 65.8 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 122.656 0.383 . . . . 0.0 110.676 178.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.68 -22.25 61.62 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 123.592 0.615 . . . . 0.0 114.296 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 63.7 m -108.49 -8.1 15.62 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.104 1.361 . . . . 0.0 111.902 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -103.27 -24.74 13.51 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.767 1.227 . . . . 0.0 112.189 -175.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -55.62 -33.27 63.84 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 120.294 1.406 . . . . 0.0 111.383 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.2 t -59.36 -36.84 76.48 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.95 0.795 . . . . 0.0 112.075 175.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.431 ' HB3' HG22 ' A' ' 8' ' ' ILE . 12.7 mt -63.19 -63.84 1.08 Allowed 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 125.14 1.376 . . . . 0.0 109.319 -175.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -32.88 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-O 117.73 -1.128 . . . . 0.0 109.793 175.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.81 -37.41 86.62 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.75 1.614 . . . . 0.0 110.418 176.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.33 -24.77 65.3 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.308 0.958 . . . . 0.0 111.374 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 58.9 t -84.98 -54.02 9.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 175.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 72.1 t -71.85 14.01 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 130.269 3.428 . . . . 0.0 113.35 -175.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -50.25 -26.55 4.84 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 119.759 -1.838 . . . . 0.0 115.119 -175.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -92.32 52.08 1.88 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.241 1.017 . . . . 0.0 109.646 175.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.08 176.46 5.12 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.72 2.008 . . . . 0.0 110.705 177.133 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.8 -67.07 0.86 Allowed 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -165.09 176.17 8.76 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 128.495 2.718 . . . . 0.0 108.734 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -113.61 173.61 6.33 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 124.663 1.185 . . . . 0.0 111.685 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -147.54 155.99 42.4 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 105.156 -2.164 . . . . 0.0 105.156 -175.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 14.3 t -129.08 124.9 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 175.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mt -125.19 141.29 45.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 125.804 1.641 . . . . 0.0 107.867 -175.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 10.2 p -131.07 -9.81 3.81 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -175.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -145.97 160.64 41.57 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 118.447 0.567 . . . . 0.0 110.771 -175.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -53.38 -42.86 67.35 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.254 1.421 . . . . 0.0 111.204 176.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -67.47 -37.15 82.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.636 0.653 . . . . 0.0 111.989 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -71.77 -23.66 61.63 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.896 0.879 . . . . 0.0 110.545 177.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -80.77 -24.56 38.55 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.095 -1.003 . . . . 0.0 113.38 -176.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -61.5 123.61 18.34 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.904 0.774 . . . . 0.0 111.492 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -54.66 -23.61 18.1 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -56.42 -49.99 72.95 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 -175.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -88.94 -25.65 21.96 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.873 177.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 34.5 mt -52.7 -43.41 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -55.0 -50.48 68.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 119.083 -0.484 . . . . 0.0 111.048 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.5 t -64.08 -43.32 95.77 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-O 118.803 -0.618 . . . . 0.0 110.604 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -53.65 -52.81 58.75 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.543 1.137 . . . . 0.0 109.372 177.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.12 -29.29 70.13 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.008 0.923 . . . . 0.0 112.159 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -72.29 -44.27 63.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.393 1.077 . . . . 0.0 110.018 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 45.8 mmtt -60.53 -53.53 56.46 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 176.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.361 0 C-N-CA 125.186 1.394 . . . . 0.0 113.103 178.5 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.3 m -64.05 157.33 25.54 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.51 2.324 . . . . 0.0 108.409 176.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -131.74 175.44 9.19 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.266 1.026 . . . . 0.0 110.119 -176.099 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.647 HG22 HG12 ' A' ' 39' ' ' ILE . 0.1 OUTLIER -121.42 151.98 24.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 O-C-N 121.541 -0.725 . . . . 0.0 110.247 176.017 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -87.19 65.71 8.95 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 104.87 -2.271 . . . . 0.0 104.87 175.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.93 -39.93 63.22 Favored 'General case' 0 CA--C 1.512 -0.482 0 C-N-CA 124.395 1.078 . . . . 0.0 111.931 -175.232 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -67.84 -35.23 78.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 118.753 0.706 . . . . 0.0 111.771 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.29 -50.26 16.64 Favored 'General case' 0 CA--C 1.523 -0.084 0 CA-C-N 119.727 1.149 . . . . 0.0 109.882 175.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.0 m -62.36 -27.79 69.31 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.906 -0.496 . . . . 0.0 110.996 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -58.52 -41.61 85.84 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 117.72 -1.133 . . . . 0.0 109.518 175.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.54 -54.32 38.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 123.779 0.674 . . . . 0.0 110.116 -175.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.08 75.15 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -52.94 -40.66 63.82 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 119.015 -0.517 . . . . 0.0 109.618 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -58.43 -48.77 79.62 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 123.448 0.699 . . . . 0.0 111.013 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mp -54.33 -56.36 19.25 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 124.029 0.932 . . . . 0.0 110.856 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.0 -30.08 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 122.146 -0.346 . . . . 0.0 111.089 -176.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.0 ttp85 -76.89 -25.05 52.59 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.382 1.073 . . . . 0.0 112.273 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -83.67 124.35 30.75 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 126.185 1.794 . . . . 0.0 112.313 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -64.83 -22.27 66.95 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 123.924 0.89 . . . . 0.0 112.869 175.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.76 -14.35 75.77 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-N 119.169 0.895 . . . . 0.0 112.854 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.5 t -70.13 146.03 51.13 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.898 1.349 . . . . 0.0 111.942 -175.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.03 -29.58 23.34 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 175.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.8 t -74.86 129.95 36.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 176.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.87 -24.02 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 O-C-N 124.296 0.997 . . . . 0.0 110.235 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -125.45 144.65 50.43 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 124.349 1.06 . . . . 0.0 109.275 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.9 t -137.53 162.78 32.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 C-N-CA 128.501 2.72 . . . . 0.0 107.631 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 51.0 p -132.06 162.22 31.31 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.601 1.161 . . . . 0.0 108.174 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -133.92 143.82 48.46 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -120.64 176.67 5.4 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.405 ' CE2' HD12 ' A' ' 39' ' ' ILE . 23.9 m-85 -120.33 141.01 50.42 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.479 0.712 . . . . 0.0 109.118 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -151.09 123.83 8.56 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.066 0.946 . . . . 0.0 109.285 175.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 54.19 -125.9 34.91 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.1 p -98.34 30.05 3.34 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 124.516 1.127 . . . . 0.0 111.945 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.6 t -151.84 165.4 34.62 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 175.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.647 HG12 HG22 ' A' ' 8' ' ' ILE . 12.2 mm -89.41 135.03 27.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 103.743 -2.688 . . . . 0.0 103.743 175.28 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.437 ' HB ' ' HD2' ' A' ' 41' ' ' PRO . 6.0 m -122.34 167.19 14.66 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 124.687 1.195 . . . . 0.0 109.297 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.437 ' HD2' ' HB ' ' A' ' 40' ' ' VAL . 57.0 Cg_endo -66.06 170.08 12.4 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 CA-C-N 120.506 1.216 . . . . 0.0 111.302 176.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -135.41 -168.11 11.5 Favored Glycine 0 CA--C 1.523 0.559 0 C-N-CA 125.614 1.578 . . . . 0.0 109.85 176.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -74.69 170.46 15.78 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 124.566 1.146 . . . . 0.0 109.731 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -146.46 168.47 21.12 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 124.949 1.3 . . . . 0.0 110.206 -176.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.33 -178.03 46.67 Favored Glycine 0 CA--C 1.521 0.41 0 CA-C-O 121.968 0.76 . . . . 0.0 112.772 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.76 -24.11 7.31 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.552 1.541 . . . . 0.0 110.776 176.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -109.12 123.21 48.83 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.4 ' CD1' ' HG3' ' A' ' 125' ' ' GLU . 33.3 t80 -83.1 -15.88 49.08 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.368 -175.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -54.11 -34.54 60.52 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 121.468 1.94 . . . . 0.0 111.666 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -66.16 -32.98 74.75 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 123.429 0.692 . . . . 0.0 112.123 175.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.95 -45.59 67.79 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.292 1.437 . . . . 0.0 109.622 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 mp -63.46 -33.12 59.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.507 -0.745 . . . . 0.0 110.958 -178.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -80.21 -26.45 39.15 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.961 1.304 . . . . 0.0 110.269 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -71.98 -39.02 69.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.451 1.5 . . . . 0.0 110.278 176.026 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 67.4 m -50.49 114.36 1.11 Allowed 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.953 1.301 . . . . 0.0 111.246 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.619 ' OG1' HG22 ' A' ' 59' ' ' VAL . 2.7 p -84.26 143.24 29.69 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 127.995 2.518 . . . . 0.0 110.635 -176.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -50.54 -59.74 3.72 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 126.172 1.789 . . . . 0.0 112.94 -177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -106.67 -33.79 7.51 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 125.496 1.518 . . . . 0.0 113.927 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.619 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -72.31 155.11 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 C-N-CA 118.086 -1.446 . . . . 0.0 109.429 -175.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.7 151.44 22.99 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -178.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.3 tp -147.48 157.35 43.53 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 124.424 1.09 . . . . 0.0 108.478 -175.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -128.84 142.77 50.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -137.46 124.08 21.01 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 123.838 0.855 . . . . 0.0 112.001 -176.184 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -95.85 123.57 39.49 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 105.27 -2.122 . . . . 0.0 105.27 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.9 t -136.53 143.57 35.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 123.365 0.666 . . . . 0.0 109.395 -175.439 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.52 136.2 33.21 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -136.27 170.76 15.51 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.755 2.022 . . . . 0.0 107.81 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--O 1.235 0.298 0 C-N-CA 125.639 1.576 . . . . 0.0 110.116 176.349 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.5 m . . . . . 0 N--CA 1.442 -0.861 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -67.79 154.57 41.23 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 87.9 mtt-85 -111.8 165.68 11.85 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.7 t -133.51 135.99 44.78 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.7 mtpp -139.87 123.97 17.75 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 125.933 1.693 . . . . 0.0 107.791 -175.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.57 134.76 33.62 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 176.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -108.01 127.9 54.18 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.542 1.537 . . . . 0.0 107.169 176.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -103.99 113.27 26.69 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 175.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.8 mp -93.74 135.46 28.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 -177.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -117.38 123.47 46.52 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 106.071 -1.825 . . . . 0.0 106.071 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 52.1 t-105 -100.96 123.41 45.11 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 105.745 -1.946 . . . . 0.0 105.745 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.7 mm -141.56 89.84 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 101.001 -3.703 . . . . 0.0 101.001 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.48 145.0 8.25 Favored Glycine 0 C--N 1.339 0.726 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.602 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.44 -5.44 7.72 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.103 0.951 . . . . 0.0 113.134 -175.441 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -83.3 -35.5 25.2 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 124.799 1.24 . . . . 0.0 111.771 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.2 p -82.71 132.78 30.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 120.074 1.307 . . . . 0.0 109.656 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.5 t -146.22 176.56 9.66 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 126.674 1.99 . . . . 0.0 108.589 -175.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 81.29 -155.48 36.2 Favored Glycine 0 CA--C 1.519 0.311 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.49 -29.56 59.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 122.963 0.505 . . . . 0.0 110.959 -177.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 -57.22 -39.41 75.42 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.872 1.669 . . . . 0.0 111.334 176.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -71.45 -53.05 15.28 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 175.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.65 -23.39 6.49 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 117.225 -1.369 . . . . 0.0 113.527 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -48.82 -44.11 38.98 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 120.678 1.581 . . . . 0.0 109.184 175.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.2 m -56.29 -27.78 56.57 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.983 1.713 . . . . 0.0 111.918 178.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -75.95 -25.92 65.75 Favored Glycine 0 CA--C 1.529 0.943 0 O-C-N 120.809 -1.182 . . . . 0.0 112.449 175.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 54.6 m -93.32 -20.18 20.64 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.806 1.242 . . . . 0.0 110.136 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -104.14 -23.97 13.22 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -174.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -58.14 -33.04 68.75 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 122.353 2.342 . . . . 0.0 111.225 177.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.9 t -68.53 -27.49 66.15 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.663 1.12 . . . . 0.0 112.25 175.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.42 ' O ' HG21 ' A' ' 8' ' ' ILE . 15.5 mt -67.85 -62.16 1.54 Allowed 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.125 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.301 0.8 OUTLIER -57.87 -24.69 23.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.313 175.471 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -63.79 -33.19 75.11 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.814 1.643 . . . . 0.0 109.57 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -62.34 -24.26 67.23 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 120.665 1.575 . . . . 0.0 111.816 175.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 92.2 t -86.01 -63.4 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 41.5 t -73.13 26.16 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 131.64 3.976 . . . . 0.0 112.71 -175.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -54.25 -26.0 26.41 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 119.751 -1.843 . . . . 0.0 111.643 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -97.37 88.84 4.52 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 175.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -153.08 176.44 11.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.436 0.636 . . . . 0.0 111.003 176.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -108.61 -66.03 1.08 Allowed 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.432 1.093 . . . . 0.0 109.982 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.98 174.88 11.11 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 119.044 0.838 . . . . 0.0 109.464 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . 0.254 0.0 OUTLIER -118.84 169.62 9.7 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.625 1.17 . . . . 0.0 109.599 175.495 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.415 ' CD1' HD11 ' A' ' 117' ' ' ILE . 0.5 OUTLIER -144.15 149.15 36.02 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 104.205 -2.517 . . . . 0.0 104.205 -175.662 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.31 123.47 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.415 HD11 ' CD1' ' A' ' 115' ' ' PHE . 2.8 mp -130.87 145.22 35.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 125.286 1.434 . . . . 0.0 107.889 -176.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 p -136.65 -9.46 1.88 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.741 1.216 . . . . 0.0 113.76 -176.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -115.42 124.46 51.22 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 176.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 17.8 ttp-105 -59.49 -36.68 76.52 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.92 0.888 . . . . 0.0 111.721 -177.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -35.96 77.05 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 120.254 1.388 . . . . 0.0 111.422 177.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.88 -41.52 91.48 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 123.744 0.653 . . . . 0.0 110.324 -175.535 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -43.61 -23.11 0.06 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 131.456 3.903 . . . . 0.0 115.425 -176.158 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -43.93 141.41 1.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.014 1.726 . . . . 0.0 111.222 175.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.4 ' HG3' ' CD1' ' A' ' 48' ' ' TYR . 7.2 mt-10 -61.42 -21.84 64.46 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -175.49 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.485 ' HA ' ' HE3' ' A' ' 129' ' ' LYS 0.276 7.9 t70 -65.81 -43.57 88.27 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 121.541 1.973 . . . . 0.0 113.448 -175.168 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.16 -26.39 60.28 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 113.84 -3.144 . . . . 0.0 106.44 -176.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 58.5 mt -60.64 -49.54 84.04 Favored 'Isoleucine or valine' 0 C--N 1.345 0.39 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 175.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.485 ' HE3' ' HA ' ' A' ' 126' ' ' ASP . 15.4 mtmt -56.26 -45.91 79.88 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.554 -0.716 . . . . 0.0 111.327 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -73.53 -38.17 65.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 119.403 1.002 . . . . 0.0 110.904 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -66.52 -43.73 84.42 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.51 1.524 . . . . 0.0 109.879 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.06 -36.69 82.39 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -67.2 -41.4 85.88 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 124.551 1.14 . . . . 0.0 111.429 175.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -62.02 -41.35 97.99 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 120.832 1.651 . . . . 0.0 109.135 175.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.661 0 C-N-CA 123.667 0.787 . . . . 0.0 112.212 175.742 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 61.2 m -116.23 161.14 19.42 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 103.766 -2.679 . . . . 0.0 103.766 175.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.536 ' HG2' ' H ' ' A' ' 8' ' ' ILE . 38.6 tttt -132.26 -174.01 3.32 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 121.144 -0.973 . . . . 0.0 110.555 -175.145 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.536 ' H ' ' HG2' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -132.39 151.68 35.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 125.825 1.65 . . . . 0.0 108.298 175.647 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -103.2 86.32 2.66 Favored 'General case' 0 C--O 1.236 0.352 1 N-CA-C 98.488 -4.634 . . . . 0.0 98.488 174.652 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -55.13 -29.37 57.57 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 116.899 -1.524 . . . . 0.0 113.757 -175.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -74.33 -50.43 18.78 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 120.878 1.672 . . . . 0.0 110.222 -176.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.14 90.0 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.63 ' HB3' HG11 ' A' ' 107' ' ' VAL . 17.1 m -68.88 -41.95 77.63 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.526 -0.734 . . . . 0.0 112.117 175.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -57.06 -37.62 72.09 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 117.85 -1.071 . . . . 0.0 109.855 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.27 -35.6 69.96 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 119.005 0.82 . . . . 0.0 111.984 -176.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.59 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -78.43 -50.17 12.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 119.185 0.902 . . . . 0.0 111.274 175.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -49.47 -43.76 45.39 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.757 1.223 . . . . 0.0 110.13 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -64.77 -43.38 93.44 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 118.348 -0.834 . . . . 0.0 111.841 -177.344 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.79 -52.26 65.82 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 119.224 0.92 . . . . 0.0 111.385 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.458 ' CG2' HG23 ' A' ' 30' ' ' VAL . 93.8 t -60.35 -34.27 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 122.439 0.296 . . . . 0.0 110.216 -177.457 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.4 ttt-85 -72.56 -32.57 66.14 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 125.158 1.383 . . . . 0.0 113.124 176.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.22 149.3 50.54 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.957 1.303 . . . . 0.0 113.887 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.57 -23.21 34.57 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.781 1.233 . . . . 0.0 113.162 -177.715 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.77 -14.67 24.55 Favored Glycine 0 CA--C 1.527 0.807 0 CA-C-N 118.782 0.719 . . . . 0.0 112.538 -177.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -64.95 123.71 20.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 118.304 1.052 . . . . 0.0 109.214 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.07 -31.94 69.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.248 175.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 t -60.62 129.41 23.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 176.049 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.4 HD12 HG13 ' A' ' 65' ' ' VAL . 1.1 pp -114.69 -24.43 3.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 124.075 0.859 . . . . 0.0 110.603 178.601 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -129.68 137.84 50.84 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.646 1.112 . . . . 0.0 109.685 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.59 HG11 ' HB1' ' A' ' 16' ' ' ALA . 23.6 t -140.6 148.39 22.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 175.282 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 42.1 p -105.56 160.32 15.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.133 0.492 . . . . 0.0 111.324 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -129.25 123.08 31.03 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 104.347 -2.464 . . . . 0.0 104.347 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.0 mmtm -100.49 176.66 5.27 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 127.407 2.283 . . . . 0.0 105.921 177.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -115.82 153.62 31.15 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -137.74 152.96 49.75 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 128.991 2.916 . . . . 0.0 105.86 175.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 12.87 -80.33 0.0 OUTLIER Glycine 0 C--N 1.339 0.737 0 C-N-CA 128.038 2.732 . . . . 0.0 115.67 175.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.9 p -129.8 23.91 5.37 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.515 1.126 . . . . 0.0 113.569 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.0 t -151.21 171.63 17.1 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -176.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 12.3 mm -92.93 139.61 17.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 C-N-CA 125.898 1.679 . . . . 0.0 107.439 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.6 m -131.48 153.93 81.73 Favored Pre-proline 0 N--CA 1.472 0.628 0 C-N-CA 124.436 1.094 . . . . 0.0 111.387 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.33 153.71 50.78 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 121.736 1.624 . . . . 0.0 109.491 175.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.69 -142.62 6.97 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 125.484 1.516 . . . . 0.0 110.744 177.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -72.73 165.39 24.9 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.841 1.256 . . . . 0.0 109.755 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.456 ' HB3' HG13 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -145.08 165.1 29.21 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 125.772 1.629 . . . . 0.0 110.809 177.087 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.6 173.78 42.01 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-O 122.731 1.184 . . . . 0.0 112.962 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.46 7.47 5.34 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.484 2.314 . . . . 0.0 110.093 176.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -133.03 127.04 33.21 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 103.422 -2.807 . . . . 0.0 103.422 -175.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -84.43 -15.99 44.22 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 115.611 1.708 . . . . 0.0 115.611 -175.1 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -58.7 -40.19 82.92 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 121.959 2.163 . . . . 0.0 109.937 176.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -60.47 -30.58 69.77 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.767 0.427 . . . . 0.0 111.039 175.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -69.66 -36.12 75.77 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.539 -0.726 . . . . 0.0 109.652 178.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.5 mm -62.87 -46.95 95.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -63.6 -35.96 82.23 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.863 1.665 . . . . 0.0 111.926 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.0 -22.98 65.04 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 124.716 1.207 . . . . 0.0 114.049 177.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.9 m -64.23 113.99 3.94 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 119.377 0.989 . . . . 0.0 108.83 -178.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.254 2.3 p -103.36 154.85 18.96 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.495 1.118 . . . . 0.0 108.168 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -41.48 -74.76 0.03 OUTLIER 'General case' 0 C--O 1.234 0.272 0 N-CA-C 117.943 2.572 . . . . 0.0 117.943 -174.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -106.17 -36.14 6.99 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -175.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.7 m -53.75 132.16 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 123.235 0.614 . . . . 0.0 110.265 -175.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.51 123.11 46.3 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 -177.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 32.7 tp -122.42 176.11 6.07 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 127.023 2.129 . . . . 0.0 111.284 -174.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -136.48 151.76 49.81 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.49 0.716 . . . . 0.0 110.233 176.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -142.92 123.42 13.99 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.739 0.815 . . . . 0.0 111.295 175.508 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.42 ' CD1' HG13 ' A' ' 108' ' ' VAL . 40.2 t80 -88.41 123.88 33.4 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 104.65 -2.352 . . . . 0.0 104.65 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.407 HG21 HD13 ' A' ' 82' ' ' ILE . 44.4 t -134.28 140.54 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-N 118.103 0.41 . . . . 0.0 109.919 -175.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.9 tmm_? -85.42 117.84 24.59 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 175.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -112.23 123.45 50.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 108.696 -175.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.1 m . . . . . 0 N--CA 1.447 -0.579 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 176.258 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.1 m . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -57.09 150.2 17.75 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 123.455 0.702 . . . . 0.0 109.703 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 75.2 mmt-85 -135.4 134.04 39.29 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 175.477 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.2 t -146.59 139.12 25.11 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 124.461 1.105 . . . . 0.0 108.316 -176.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -142.41 176.63 8.85 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.508 1.523 . . . . 0.0 107.214 177.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -131.52 124.35 29.91 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 -176.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -111.56 114.12 26.98 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 104.108 -2.553 . . . . 0.0 104.108 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.9 tt -82.88 113.15 20.3 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 105.361 -2.088 . . . . 0.0 105.361 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.561 HG23 HD12 ' A' ' 117' ' ' ILE . 3.1 mp -79.4 123.8 36.8 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 N-CA-C 105.458 -2.053 . . . . 0.0 105.458 175.651 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.8 m -106.4 123.11 47.57 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 101.242 -3.614 . . . . 0.0 101.242 175.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -95.49 124.06 39.34 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.475 HD11 HG21 ' A' ' 97' ' ' THR . 10.5 mm -133.94 81.92 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 N-CA-C 103.696 -2.705 . . . . 0.0 103.696 177.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -44.26 130.47 7.09 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 107.986 -2.046 . . . . 0.0 107.986 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -56.0 -10.64 0.84 Allowed 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.229 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -83.21 -28.17 29.45 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 117.576 -1.202 . . . . 0.0 110.804 177.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.7 p -71.03 133.53 31.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 120.744 1.611 . . . . 0.0 109.064 -177.342 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 42.5 t -146.31 176.18 9.96 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.84 1.656 . . . . 0.0 107.011 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.65 -157.2 53.52 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 95' ' ' ALA . 5.1 tt -60.23 -30.98 69.76 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-O 118.049 -0.977 . . . . 0.0 112.047 -175.757 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -58.17 -45.15 87.98 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 120.304 1.411 . . . . 0.0 110.109 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -36.25 76.98 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 175.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.421 ' HB3' ' HA ' ' A' ' 92' ' ' LEU . . . -62.32 -23.57 66.82 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.084 -0.96 . . . . 0.0 112.573 177.026 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -56.19 -54.35 46.25 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-N 119.919 1.236 . . . . 0.0 108.861 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.475 HG21 HD11 ' A' ' 85' ' ' ILE . 54.0 m -52.28 -40.41 61.72 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 175.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -55.4 -24.78 39.22 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-O 118.864 -0.964 . . . . 0.0 115.415 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.2 m -115.7 -6.64 12.15 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.184 1.492 . . . . 0.0 112.201 176.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -103.91 -23.46 13.36 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 125.733 1.613 . . . . 0.0 111.974 -175.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.4 mtmp? -53.31 -29.88 36.0 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.44 1.473 . . . . 0.0 111.981 176.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -63.69 -36.83 85.15 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.942 0.897 . . . . 0.0 111.137 176.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 18.1 mt -64.81 -62.27 1.67 Allowed 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 125.363 1.465 . . . . 0.0 108.723 -176.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.409 ' H ' HG12 ' A' ' 104' ' ' VAL 0.264 0.9 OUTLIER -61.14 -28.1 43.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.472 176.354 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 34.1 tttm -62.14 -40.56 96.35 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 121.246 1.839 . . . . 0.0 109.43 175.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -57.51 -24.51 56.33 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.687 1.13 . . . . 0.0 112.253 177.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.63 HG11 ' HB3' ' A' ' 13' ' ' CYS . 55.3 t -84.62 -63.24 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 175.268 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.42 HG13 ' CD1' ' A' ' 64' ' ' PHE . 87.1 t -65.22 26.46 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.873 1 C-N-CA 132.289 4.236 . . . . 0.0 113.644 -175.612 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -54.12 -27.05 30.81 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 119.314 -2.116 . . . . 0.0 114.035 -175.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -90.78 79.86 5.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 175.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -148.58 176.32 10.43 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 122.375 0.27 . . . . 0.0 110.591 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.42 -59.29 2.02 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.982 0.913 . . . . 0.0 111.04 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -147.54 171.94 14.77 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 125.335 1.454 . . . . 0.0 110.248 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -123.51 134.02 53.93 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -107.1 144.37 33.89 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 104.998 -2.223 . . . . 0.0 104.998 -174.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.6 t -104.0 123.54 57.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 175.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.561 HD12 HG23 ' A' ' 82' ' ' ILE . 98.9 mt -129.08 137.25 57.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 106.225 -1.768 . . . . 0.0 106.225 -175.4 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.5 p -142.69 -4.01 0.98 Allowed 'General case' 0 C--O 1.239 0.528 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -175.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -146.82 152.13 38.24 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.103 1.361 . . . . 0.0 109.229 -175.282 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -60.11 -36.17 76.85 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 117.313 -1.327 . . . . 0.0 112.361 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -63.08 -37.45 87.27 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 121.273 1.851 . . . . 0.0 110.584 176.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -68.13 -23.17 64.86 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.108 2.163 . . . . 0.0 111.485 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -84.82 -23.37 29.13 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.256 1.822 . . . . 0.0 113.349 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -59.35 125.76 24.9 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 120.102 1.319 . . . . 0.0 112.12 -175.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -56.9 -27.93 61.33 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.254 -0.904 . . . . 0.0 113.316 176.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -54.59 -60.68 3.03 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 123.575 0.75 . . . . 0.0 111.249 -177.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -80.56 -24.22 39.39 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 117.769 -1.572 . . . . 0.0 109.017 -175.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 27.8 mt -54.47 -47.34 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 175.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -54.09 -49.89 68.07 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 118.78 0.718 . . . . 0.0 112.038 175.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.8 t -71.91 -29.16 64.02 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.598 0.635 . . . . 0.0 111.661 -176.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -72.11 -47.14 53.43 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 119.301 0.955 . . . . 0.0 109.165 176.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 78.0 mt -60.17 -36.95 78.73 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 175.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.0 mtmt -61.68 -53.21 59.21 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 175.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? -57.05 -45.77 82.96 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.976 1.262 . . . . 0.0 111.209 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 CA-C-O 117.964 -1.017 . . . . 0.0 112.873 179.145 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.433 ' HB ' HD11 ' A' ' 103' ' ' LEU . 3.2 m -142.6 162.07 36.42 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.565 1.946 . . . . 0.0 106.621 -176.328 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.1 mtpt -131.62 -173.06 3.02 Favored 'General case' 0 CA--C 1.516 -0.328 0 O-C-N 121.316 -0.865 . . . . 0.0 111.303 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.13 148.38 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 C-N-CA 126.908 2.083 . . . . 0.0 105.654 175.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -88.31 74.05 8.74 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 101.9 -3.37 . . . . 0.0 101.9 175.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.85 -44.61 59.52 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 125.391 1.477 . . . . 0.0 112.875 -174.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -65.47 -49.34 69.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.083 0.856 . . . . 0.0 109.738 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.56 -34.39 74.11 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.322 -0.861 . . . . 0.0 112.0 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.5 m -74.78 -38.02 62.27 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.451 178.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.2 ttm180 -59.95 -27.25 66.65 Favored 'General case' 0 C--N 1.342 0.263 0 CA-C-O 116.975 -1.488 . . . . 0.0 111.17 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.06 -60.78 3.24 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 120.089 1.313 . . . . 0.0 110.465 176.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.445 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -62.38 -40.2 95.66 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.013 0.824 . . . . 0.0 111.073 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -58.77 -36.34 74.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.545 176.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -62.19 -44.96 95.41 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 119.925 1.239 . . . . 0.0 110.604 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.6 mp -56.68 -61.84 2.14 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 175.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.418 ' CG2' HG23 ' A' ' 30' ' ' VAL . 42.3 t -58.21 -34.44 49.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 O-C-N 121.742 -0.599 . . . . 0.0 111.498 -176.498 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.2 ttt-85 -67.71 -38.16 83.25 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 124.683 1.193 . . . . 0.0 111.213 175.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -66.56 137.07 56.5 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.891 0.876 . . . . 0.0 108.737 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.6 -11.06 57.8 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 125.279 1.432 . . . . 0.0 111.373 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -98.45 5.85 60.82 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.724 1.63 . . . . 0.0 112.225 175.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -85.63 141.55 29.72 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.248 1.524 . . . . 0.0 109.936 176.389 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -80.28 -29.0 38.24 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 175.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.9 t -73.62 125.03 32.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 175.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 pp -115.16 -24.49 3.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.816 1.246 . . . . 0.0 111.312 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.0 p-90 -125.38 145.21 50.15 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 119.224 0.92 . . . . 0.0 108.777 177.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.445 HG21 ' HB1' ' A' ' 16' ' ' ALA . 6.1 t -135.71 158.84 39.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 127.389 2.276 . . . . 0.0 106.151 176.135 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.449 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 42.0 p -119.15 154.5 33.19 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -126.69 123.58 37.85 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 176.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -107.04 176.72 5.08 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.171 2.188 . . . . 0.0 105.347 -175.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -116.94 155.53 28.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.485 0.659 . . . . 0.0 109.509 176.226 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -142.26 166.71 23.94 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 127.306 2.242 . . . . 0.0 105.906 175.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 14.07 -88.78 0.0 OUTLIER Glycine 0 CA--C 1.531 1.06 0 C-N-CA 128.385 2.898 . . . . 0.0 114.988 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 p -135.59 44.17 2.55 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 126.24 1.816 . . . . 0.0 109.312 175.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -155.1 174.29 15.39 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -176.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.3 mm -103.47 139.55 24.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 126.22 1.808 . . . . 0.0 106.968 175.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 16.6 m -135.66 160.54 67.25 Favored Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 124.98 1.312 . . . . 0.0 110.902 -178.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.87 149.11 53.15 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.525 2.15 . . . . 0.0 110.444 175.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -115.43 -145.95 8.72 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 126.706 2.098 . . . . 0.0 109.676 175.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -70.26 164.65 23.92 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -144.95 168.64 19.76 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.849 1.26 . . . . 0.0 108.49 175.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.81 174.92 46.91 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-O 121.88 0.711 . . . . 0.0 113.076 -177.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.64 -26.07 8.81 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.693 1.997 . . . . 0.0 110.691 176.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.02 129.18 55.45 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 -176.116 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -83.94 -8.5 59.15 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.404 1.261 . . . . 0.0 114.404 -174.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -58.56 -40.12 82.18 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 119.497 -2.002 . . . . 0.0 109.048 175.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -66.48 -22.54 66.19 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.597 -0.689 . . . . 0.0 111.601 176.106 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -66.61 -36.25 82.14 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-N 119.472 1.033 . . . . 0.0 109.801 176.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.9 mm -60.02 -39.7 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -72.7 -23.35 60.86 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.849 1.66 . . . . 0.0 113.313 175.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -73.97 -24.92 59.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 120.79 1.632 . . . . 0.0 110.036 175.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 79.9 m -71.56 159.37 34.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.598 -0.689 . . . . 0.0 109.432 176.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.629 ' OG1' HG22 ' A' ' 59' ' ' VAL . 16.7 p -132.63 -174.33 3.43 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.73 1.212 . . . . 0.0 112.644 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -77.01 -67.46 0.71 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.304 1.442 . . . . 0.0 108.448 175.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -106.45 -27.92 10.64 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 -175.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.629 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -65.58 167.77 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-N 121.997 2.18 . . . . 0.0 113.428 -175.162 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.2 124.87 45.74 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 175.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 56.2 tp -129.02 159.09 37.02 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 126.171 1.788 . . . . 0.0 107.962 -175.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -123.81 157.82 33.21 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.449 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -147.2 141.62 26.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 118.126 0.421 . . . . 0.0 111.319 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -106.54 123.58 48.31 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 176.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.2 t -135.62 138.15 48.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.834 0.826 . . . . 0.0 112.136 -175.25 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.5 ttm-85 -79.33 117.71 20.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 128.388 2.675 . . . . 0.0 107.15 175.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -136.18 167.75 20.69 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.7 m . . . . . 0 C--N 1.327 -0.401 0 O-C-N 120.8 -1.187 . . . . 0.0 107.804 175.985 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 75.3 m . . . . . 0 N--CA 1.442 -0.827 0 N-CA-C 103.76 -2.681 . . . . 0.0 103.76 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -64.37 158.5 23.47 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.661 -176.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.9 mtt180 -116.61 170.87 8.25 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.7 t -145.64 124.3 12.54 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 175.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -116.64 123.35 47.07 Favored 'General case' 0 CA--C 1.5 -0.979 0 C-N-CA 125.753 1.621 . . . . 0.0 107.361 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -86.31 131.46 34.21 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.713 -1.131 . . . . 0.0 108.683 -178.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.68 122.19 45.56 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.044 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -95.21 113.22 24.88 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 101.029 -3.693 . . . . 0.0 101.029 174.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -97.41 143.17 13.05 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 -176.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.7 m -126.18 123.5 38.37 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 175.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.3 t-105 -100.85 128.09 47.03 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 104.021 -2.585 . . . . 0.0 104.021 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.426 HD11 HG21 ' A' ' 97' ' ' THR . 7.5 mt -132.27 103.03 6.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 104.27 -2.492 . . . . 0.0 104.27 176.134 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.43 ' O ' HG12 ' A' ' 89' ' ' VAL . . . -48.7 138.09 15.18 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 176.56 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -66.62 -7.22 18.93 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.747 -1.443 . . . . 0.0 111.953 -176.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -85.45 -34.78 21.58 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 117.188 -1.387 . . . . 0.0 113.072 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.43 HG12 ' O ' ' A' ' 86' ' ' GLY . 3.2 p -64.39 124.1 18.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 120.941 1.701 . . . . 0.0 109.863 -175.655 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.8 t -65.82 162.13 19.5 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 122.616 1.198 . . . . 0.0 113.262 -175.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.02 -30.07 72.55 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 125.32 1.438 . . . . 0.0 113.715 -176.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.7 -46.95 87.5 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 118.478 1.139 . . . . 0.0 108.355 175.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -67.48 -41.96 83.71 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 123.171 0.588 . . . . 0.0 109.526 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -58.74 -24.95 62.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.739 0.7 . . . . 0.0 110.408 175.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.97 -39.17 93.87 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.061 -1.024 . . . . 0.0 110.531 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.65 -41.53 77.36 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 118.979 0.809 . . . . 0.0 108.849 176.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.426 HG21 HD11 ' A' ' 85' ' ' ILE . 3.4 m -59.1 -30.25 67.97 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.636 -176.281 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -70.88 -26.38 74.08 Favored Glycine 0 CA--C 1.532 1.128 0 CA-C-N 119.739 1.154 . . . . 0.0 112.448 175.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 33.5 m -89.48 -10.92 44.54 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.425 1.49 . . . . 0.0 109.974 175.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -103.46 -27.82 12.16 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.422 -0.799 . . . . 0.0 111.375 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -53.5 -51.94 61.18 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 119.767 1.167 . . . . 0.0 109.745 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -58.67 -34.62 71.46 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 123.455 0.702 . . . . 0.0 110.88 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.433 HD11 ' HB ' ' A' ' 6' ' ' THR . 14.8 mt -64.09 -62.39 1.66 Allowed 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 124.014 0.926 . . . . 0.0 110.074 178.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.253 0.9 OUTLIER -60.32 -25.72 34.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 118.481 -1.288 . . . . 0.0 110.224 176.503 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -67.92 -26.41 65.96 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 120.534 1.515 . . . . 0.0 109.729 175.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.68 -25.98 68.45 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.957 1.708 . . . . 0.0 110.729 175.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 79.0 t -86.16 -58.01 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 175.234 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 60.7 t -73.4 26.32 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 130.358 3.463 . . . . 0.0 111.695 -175.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.43 -26.19 64.97 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 119.814 -1.804 . . . . 0.0 111.261 -176.202 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -91.94 70.91 5.55 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 175.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.13 175.94 8.94 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.044 0.449 . . . . 0.0 111.001 176.181 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.85 -66.33 0.94 Allowed 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 108.696 -0.854 . . . . 0.0 108.696 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.97 175.08 13.44 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 128.343 2.657 . . . . 0.0 107.233 175.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -100.52 178.5 4.71 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 124.509 1.124 . . . . 0.0 112.692 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -143.43 144.54 32.07 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 103.712 -2.699 . . . . 0.0 103.712 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 57.5 t -123.22 131.12 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 175.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -129.64 147.99 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 126.551 1.94 . . . . 0.0 109.335 -175.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.3 p -146.02 9.42 1.13 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.507 1.123 . . . . 0.0 113.08 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -142.51 147.11 35.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -178.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -62.59 -24.22 67.45 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 119.777 1.172 . . . . 0.0 110.213 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -68.34 -55.05 13.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 175.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -56.73 -23.48 42.84 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.706 1.602 . . . . 0.0 111.073 175.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -79.68 -22.84 42.96 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.491 1.916 . . . . 0.0 113.482 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -60.22 124.77 21.29 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 119.488 1.04 . . . . 0.0 112.667 -177.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.406 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 11.9 mm-40 -58.27 -26.71 63.29 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 176.079 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -48.71 -66.32 0.42 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.181 1.792 . . . . 0.0 111.182 177.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -78.19 -21.76 49.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 117.077 -1.849 . . . . 0.0 108.768 -176.11 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.406 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 72.6 mt -55.13 -43.02 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 120.03 1.286 . . . . 0.0 107.793 176.127 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -54.18 -54.07 44.76 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 119.709 1.14 . . . . 0.0 111.393 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 47.5 t -67.19 -36.28 81.42 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.785 0.721 . . . . 0.0 111.103 -177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -61.7 -48.86 78.85 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.048 1.339 . . . . 0.0 109.402 176.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.68 -36.42 83.78 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.284 177.123 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -61.54 -55.55 29.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 175.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -56.01 -52.2 65.05 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 127.333 2.253 . . . . 0.0 111.5 -178.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.399 0 O-C-N 121.393 -0.817 . . . . 0.0 111.798 178.348 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.414 0 CA-C-O 123.203 1.478 . . . . 0.0 110.043 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.7 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.4 m -96.27 171.24 8.71 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 127.463 2.305 . . . . 0.0 105.597 175.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.4 tttp -138.85 -170.95 2.97 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 120.787 -1.196 . . . . 0.0 111.268 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -140.2 151.36 21.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 124.342 1.057 . . . . 0.0 111.193 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -95.44 79.05 3.42 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 101.37 -3.567 . . . . 0.0 101.37 174.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -58.63 -33.08 69.64 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 116.569 -1.681 . . . . 0.0 112.188 -175.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -73.54 -54.32 8.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 119.283 0.947 . . . . 0.0 109.199 -176.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.67 -35.5 76.4 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 119.529 -0.272 . . . . 0.0 111.011 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.46 ' HB3' HG11 ' A' ' 107' ' ' VAL . 77.6 m -76.74 -32.3 57.68 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 117.811 -1.09 . . . . 0.0 110.819 175.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.78 -37.96 77.46 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 116.326 -1.797 . . . . 0.0 108.621 177.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.7 -61.62 2.19 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 119.521 1.055 . . . . 0.0 108.966 -177.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.461 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -68.12 -33.82 75.22 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.612 -0.68 . . . . 0.0 111.236 -176.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -59.32 -38.59 80.66 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.417 0.687 . . . . 0.0 110.239 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -66.06 -45.06 82.67 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 124.636 1.175 . . . . 0.0 109.04 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -54.69 -57.52 11.17 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 118.716 0.689 . . . . 0.0 109.267 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.6 t -61.07 -24.07 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 123.085 0.554 . . . . 0.0 112.335 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 -45.03 15.52 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 121.177 -0.952 . . . . 0.0 109.474 175.645 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -51.53 123.33 9.64 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 126.66 1.984 . . . . 0.0 110.943 -175.573 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -73.41 -9.87 59.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.489 -176.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.46 -8.09 50.24 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-O 118.914 -0.937 . . . . 0.0 112.576 175.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.6 t -68.39 148.03 51.25 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 118.744 1.272 . . . . 0.0 111.176 -175.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.13 -36.03 19.82 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.051 -1.432 . . . . 0.0 107.185 174.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.7 t -68.91 123.89 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.91 -24.46 3.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 124.392 1.077 . . . . 0.0 110.642 177.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -121.59 142.45 50.09 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.866 1.266 . . . . 0.0 108.179 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.461 HG21 ' HB1' ' A' ' 16' ' ' ALA . 7.3 t -137.98 160.19 33.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 126.606 1.962 . . . . 0.0 106.652 176.258 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 76.9 p -126.75 156.87 40.5 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 175.49 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -129.83 130.94 45.92 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.0 mmmt -103.8 176.1 5.26 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -123.88 139.79 53.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 176.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -131.54 123.3 27.69 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 175.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 47.31 -100.85 0.03 OUTLIER Glycine 0 CA--C 1.525 0.691 0 C-N-CA 124.606 1.098 . . . . 0.0 112.105 -176.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.3 p -120.23 42.72 2.89 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.617 1.167 . . . . 0.0 111.91 177.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.2 t -152.83 160.69 43.1 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.799 1.181 . . . . 0.0 111.4 175.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 21.3 mm -90.79 136.33 24.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.406 ' HB ' ' HD2' ' A' ' 41' ' ' PRO . 3.2 m -131.63 163.58 48.75 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 124.493 1.117 . . . . 0.0 109.976 178.471 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.406 ' HD2' ' HB ' ' A' ' 40' ' ' VAL . 73.0 Cg_endo -69.97 164.63 34.05 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.017 1.811 . . . . 0.0 111.242 175.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.1 -146.92 5.79 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 126.312 1.911 . . . . 0.0 108.856 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.81 161.12 26.89 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.878 1.271 . . . . 0.0 110.852 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.27 153.78 36.75 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.307 1.843 . . . . 0.0 110.266 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 174.5 -172.28 45.26 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-N 119.209 0.913 . . . . 0.0 113.279 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.69 -20.47 10.09 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 126.28 1.832 . . . . 0.0 113.002 -176.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -109.18 123.09 48.66 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 -176.006 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -82.35 -6.62 59.38 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.257 0.623 . . . . 0.0 112.49 -175.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -57.31 -29.29 63.8 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 120.83 -1.169 . . . . 0.0 112.7 177.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -74.6 -36.2 62.97 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.201 1.0 . . . . 0.0 111.239 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -56.76 -40.98 76.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 126.837 2.055 . . . . 0.0 109.087 -176.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.8 mm -55.57 -44.04 74.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 124.043 0.937 . . . . 0.0 108.583 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -85.43 -27.77 25.53 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.229 1.012 . . . . 0.0 111.988 -178.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -63.56 -27.26 69.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 118.323 -0.846 . . . . 0.0 111.259 176.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 75.4 m -60.8 120.45 10.14 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.252 2.1 p -83.96 158.94 21.37 Favored 'General case' 0 N--CA 1.437 -1.078 0 C-N-CA 125.339 1.455 . . . . 0.0 108.992 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -50.41 -73.77 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 126.668 1.987 . . . . 0.0 115.499 -175.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -105.83 -36.49 7.0 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.161 1.385 . . . . 0.0 113.703 -175.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.401 HG13 ' H ' ' A' ' 59' ' ' VAL . 1.8 m -60.8 159.86 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.452 0.701 . . . . 0.0 111.857 -175.333 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.77 151.04 23.52 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.197 0.599 . . . . 0.0 109.443 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.8 tp -150.6 168.04 25.47 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.383 1.473 . . . . 0.0 108.494 -176.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -131.58 154.95 48.32 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.079 0.551 . . . . 0.0 109.688 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -147.36 167.52 24.12 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 123.453 0.701 . . . . 0.0 112.339 176.434 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -141.09 123.28 15.65 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.8 t -136.12 130.79 48.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.03 114.14 16.61 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 176.605 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -118.24 170.75 8.63 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 124.36 1.064 . . . . 0.0 108.641 -175.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 89.8 m . . . . . 0 N--CA 1.45 -0.465 0 O-C-N 120.451 -1.406 . . . . 0.0 110.558 -175.898 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.237 0.433 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.9 mtmt -61.46 160.08 11.67 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.4 0.619 . . . . 0.0 110.522 176.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 -123.48 158.74 30.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 175.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.1 t -146.16 137.39 24.6 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 175.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -140.34 123.89 17.08 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -87.89 141.17 28.8 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.5 114.72 23.88 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.085 1.354 . . . . 0.0 109.282 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.33 113.57 21.24 Favored 'General case' 0 C--O 1.225 -0.237 0 N-CA-C 103.664 -2.717 . . . . 0.0 103.664 175.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.2 mt -105.31 142.66 17.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 m -126.27 123.57 38.4 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 175.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.7 t-105 -90.29 123.44 34.06 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 103.798 -2.668 . . . . 0.0 103.798 175.165 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 4.7 mm -137.56 86.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 103.563 -2.754 . . . . 0.0 103.563 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.76 147.36 6.89 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -178.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -54.29 -21.82 10.28 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.897 0.702 . . . . 0.0 112.897 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -83.12 -34.76 26.01 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 117.321 -1.323 . . . . 0.0 112.078 -175.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.82 136.09 26.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 120.489 1.495 . . . . 0.0 109.88 -178.455 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.7 t -145.82 176.71 9.46 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 127.125 2.17 . . . . 0.0 107.396 -176.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.72 -156.81 53.52 Favored Glycine 0 N--CA 1.45 -0.405 0 CA-C-O 121.535 0.519 . . . . 0.0 112.148 175.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 tt -51.63 -36.78 47.39 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.799 1.24 . . . . 0.0 111.269 -176.148 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.4 mp0 -63.7 -35.68 81.35 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 119.565 1.075 . . . . 0.0 112.141 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -76.06 -49.72 16.71 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 175.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.22 -29.21 63.55 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.299 1.44 . . . . 0.0 113.296 -175.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -48.47 -37.74 18.19 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 119.778 1.172 . . . . 0.0 111.415 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 20.3 m -58.16 -32.28 68.04 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.889 0.768 . . . . 0.0 111.893 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.24 -25.97 72.46 Favored Glycine 0 CA--C 1.53 0.985 0 O-C-N 120.86 -1.15 . . . . 0.0 112.34 177.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.5 m -105.75 -16.69 14.6 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.489 1.915 . . . . 0.0 111.633 -176.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -103.95 -25.85 12.87 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 126.086 1.754 . . . . 0.0 112.073 -175.202 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 19.3 mtmt -56.67 -26.65 56.96 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.453 1.479 . . . . 0.0 112.311 175.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -62.3 -38.31 88.88 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 118.942 0.792 . . . . 0.0 109.84 176.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.7 HD11 ' HB ' ' A' ' 6' ' ' THR . 39.6 mt -68.88 -61.41 1.81 Allowed 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 125.849 1.66 . . . . 0.0 109.576 -176.522 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.286 1.4 p -55.89 -30.87 29.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 118.052 -0.975 . . . . 0.0 108.514 176.15 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.55 -39.06 93.43 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 120.626 1.557 . . . . 0.0 109.617 175.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -54.95 -29.04 55.66 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 121.487 1.949 . . . . 0.0 111.701 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.46 HG11 ' HB3' ' A' ' 13' ' ' CYS . 79.7 t -86.1 -52.35 12.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 119.258 0.935 . . . . 0.0 109.227 175.571 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.2 t -79.21 14.82 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 129.432 3.093 . . . . 0.0 115.116 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -55.72 -26.21 44.17 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 122.381 2.355 . . . . 0.0 112.866 -176.026 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -84.85 63.7 8.19 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 175.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -137.47 176.4 8.74 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.674 0.789 . . . . 0.0 109.52 176.14 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.93 -66.38 1.0 Allowed 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 124.096 0.873 . . . . 0.0 110.216 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -148.26 176.21 10.44 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.818 1.647 . . . . 0.0 109.614 -176.508 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -121.37 171.94 8.4 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 125.021 1.328 . . . . 0.0 111.467 -177.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -145.61 147.98 32.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 17.2 t -126.32 125.68 67.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 175.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.3 mt -121.79 143.93 32.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 125.979 1.712 . . . . 0.0 109.214 -175.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.9 p -137.42 1.39 2.39 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -142.87 153.43 43.14 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -177.128 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -62.52 -38.74 91.14 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.719 0.69 . . . . 0.0 110.237 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -61.47 -45.28 94.94 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 119.091 0.859 . . . . 0.0 109.232 175.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -62.47 -23.94 67.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.813 1.245 . . . . 0.0 111.011 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -83.68 -23.86 31.54 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.074 1.75 . . . . 0.0 113.02 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -62.65 124.07 20.02 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.75 0.705 . . . . 0.0 112.127 -175.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.71 -26.07 66.88 Favored 'General case' 0 CA--C 1.527 0.077 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -56.7 -45.18 81.98 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -175.298 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -89.61 -24.42 21.68 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 117.961 -1.019 . . . . 0.0 109.102 178.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 24.8 mt -56.68 -40.92 72.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 N-CA-C 106.65 -1.611 . . . . 0.0 106.65 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.3 mtpm? -53.59 -52.46 59.72 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 118.593 0.633 . . . . 0.0 110.215 175.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 9.2 t -65.64 -37.94 87.96 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.468 0.707 . . . . 0.0 111.108 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -61.4 -53.88 50.82 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.85 1.66 . . . . 0.0 108.934 177.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 76.2 mt -62.0 -34.18 75.71 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 125.103 1.361 . . . . 0.0 110.098 175.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.03 -50.25 74.1 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 120.434 1.47 . . . . 0.0 110.643 175.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt -62.01 -49.65 75.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 120.352 1.433 . . . . 0.0 109.08 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.869 0 C-N-CA 124.227 1.011 . . . . 0.0 111.988 175.729 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.6 m -63.56 157.72 22.97 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.005 1.722 . . . . 0.0 106.644 176.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.96 -173.04 2.66 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 120.668 -1.27 . . . . 0.0 112.021 -175.277 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.66 149.26 29.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 124.005 0.922 . . . . 0.0 109.413 177.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -94.6 71.08 3.61 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 103.554 -2.758 . . . . 0.0 103.554 175.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -56.67 -34.09 67.03 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-O 117.909 -1.044 . . . . 0.0 111.517 -175.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -70.09 -38.67 75.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 119.828 1.194 . . . . 0.0 110.615 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.81 -49.32 18.41 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 121.827 -0.546 . . . . 0.0 110.057 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.3 m -62.1 -38.02 87.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.699 -0.626 . . . . 0.0 111.56 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -62.49 -31.59 72.37 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 116.289 -1.815 . . . . 0.0 110.327 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.38 -54.38 47.48 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 120.766 1.621 . . . . 0.0 110.727 178.141 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.492 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -70.59 -40.06 73.47 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.516 -0.74 . . . . 0.0 111.486 -178.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -55.66 -43.01 75.9 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 118.406 -0.807 . . . . 0.0 109.683 176.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -57.54 -45.0 85.61 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.487 1.115 . . . . 0.0 111.043 -177.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mp -59.45 -63.04 1.44 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.324 0.65 . . . . 0.0 110.099 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.5 t -58.35 -30.56 40.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 123.108 0.563 . . . . 0.0 111.84 -176.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.24 -28.2 63.0 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.894 1.277 . . . . 0.0 111.342 175.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -71.18 155.73 40.4 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.682 0.673 . . . . 0.0 109.7 -174.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -86.43 -18.5 31.57 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.954 1.302 . . . . 0.0 113.297 177.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.29 -2.43 38.38 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 125.155 1.359 . . . . 0.0 114.586 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.3 t -69.66 135.34 49.77 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 119.574 1.687 . . . . 0.0 110.407 -178.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.74 -25.52 56.63 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 55.2 t -78.27 123.9 35.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 175.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.2 pp -112.66 -23.7 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.673 1.189 . . . . 0.0 111.155 -176.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 38.2 p-90 -130.05 153.69 48.19 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 122.013 0.911 . . . . 0.0 111.008 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.492 HG21 ' HB1' ' A' ' 16' ' ' ALA . 5.2 t -139.6 165.89 21.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 128.579 2.752 . . . . 0.0 108.622 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 30.9 p -126.0 160.86 28.92 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.487 1.115 . . . . 0.0 109.0 175.637 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -132.86 126.67 32.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.8 mmmt -109.44 171.5 7.41 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.421 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 49.6 m-85 -121.65 143.68 49.2 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 175.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -139.19 123.54 18.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 35.43 -98.98 0.01 OUTLIER Glycine 0 CA--C 1.532 1.099 0 C-N-CA 126.916 2.198 . . . . 0.0 115.068 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 m -104.4 18.3 22.43 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.253 1.421 . . . . 0.0 113.941 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.2 t -146.37 169.0 19.75 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 120.748 1.613 . . . . 0.0 114.166 -175.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.421 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 17.5 mm -99.21 132.96 43.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 104.39 -2.448 . . . . 0.0 104.39 175.339 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.3 m -126.16 154.96 74.34 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 175.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.75 162.87 36.85 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 CA-C-N 121.357 1.52 . . . . 0.0 109.565 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.5 -158.63 10.43 Favored Glycine 0 CA--C 1.523 0.575 0 C-N-CA 126.517 2.008 . . . . 0.0 108.69 175.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -60.23 167.59 2.35 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 122.073 0.939 . . . . 0.0 112.694 176.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -138.0 161.64 36.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.752 2.021 . . . . 0.0 110.271 -175.592 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.42 176.74 43.93 Favored Glycine 0 CA--C 1.527 0.785 0 CA-C-O 122.029 0.794 . . . . 0.0 113.346 178.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -125.77 -3.46 7.15 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.494 1.918 . . . . 0.0 112.042 -176.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -131.22 127.78 38.6 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 127.27 2.228 . . . . 0.0 105.889 -175.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -83.17 -15.85 48.97 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 118.357 -0.83 . . . . 0.0 109.407 -175.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -55.82 -36.31 67.34 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 120.139 1.336 . . . . 0.0 109.595 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -65.63 -29.27 69.82 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 118.406 -0.806 . . . . 0.0 112.015 176.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.426 ' CD1' HD11 ' A' ' 123' ' ' LEU . 1.0 OUTLIER -61.27 -51.67 67.93 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 124.42 1.088 . . . . 0.0 108.936 178.953 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.8 mp -62.75 -34.7 67.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 O-C-N 121.665 -0.647 . . . . 0.0 109.648 -175.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -73.92 -35.0 64.56 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.131 0.878 . . . . 0.0 111.226 176.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -61.93 -33.42 74.23 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.939 1.296 . . . . 0.0 112.893 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 89.9 m -50.64 121.49 5.89 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.077 0.951 . . . . 0.0 110.337 -176.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 p -84.15 170.69 13.55 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 128.532 2.733 . . . . 0.0 111.798 -176.03 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 10.2 p-10 -69.9 -76.87 0.09 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.942 2.097 . . . . 0.0 115.957 -174.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.423 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 3.2 t70 -106.51 -30.57 8.98 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 127.106 2.162 . . . . 0.0 112.402 -176.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.5 m -55.18 156.24 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-O 122.966 1.365 . . . . 0.0 111.451 -175.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.0 123.81 48.72 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 176.323 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.5 tp -129.29 165.98 20.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.628 1.571 . . . . 0.0 109.317 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -132.01 152.25 51.25 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.484 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -138.01 155.05 49.24 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.009 1.324 . . . . 0.0 111.268 177.038 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -127.9 123.49 35.12 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.956 -2.239 . . . . 0.0 104.956 177.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.1 t -132.5 135.77 57.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -80.48 123.69 28.28 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 175.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -126.25 169.88 12.43 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.929 1.292 . . . . 0.0 108.029 -176.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.446 -0.628 0 O-C-N 120.162 -1.586 . . . . 0.0 108.683 -179.6 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -61.56 151.41 33.23 Favored 'General case' 0 C--N 1.339 0.136 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 177.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -137.47 161.97 34.92 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 103.796 -2.668 . . . . 0.0 103.796 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.1 t -142.05 149.14 39.55 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 176.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -131.15 172.38 12.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -141.69 139.67 33.0 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 177.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -116.47 117.58 30.3 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -176.259 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.421 HD22 ' O ' ' A' ' 63' ' ' ALA . 1.7 tm? -91.47 113.64 25.96 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 102.138 -3.282 . . . . 0.0 102.138 175.209 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.3 mp -105.75 125.73 61.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -101.84 123.51 45.9 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 56.0 t-105 -95.33 123.41 38.84 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 104.729 -2.323 . . . . 0.0 104.729 175.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.3 mt -143.92 98.36 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 -179.52 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -63.32 166.79 24.69 Favored Glycine 0 CA--C 1.534 1.226 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 175.627 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -77.97 -12.01 59.95 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.344 -1.68 . . . . 0.0 110.628 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -83.07 -27.43 30.27 Favored 'General case' 0 C--O 1.237 0.426 0 O-C-N 120.14 -1.6 . . . . 0.0 112.17 -175.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.3 p -67.43 123.85 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 104.75 -2.315 . . . . 0.0 104.75 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.7 t -66.23 158.73 28.13 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 122.203 1.001 . . . . 0.0 111.4 -175.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.92 -24.43 49.81 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.411 1.482 . . . . 0.0 113.196 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 9.8 tt -67.99 -50.79 53.5 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-N 119.354 1.577 . . . . 0.0 109.641 176.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -63.96 -43.65 95.16 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 176.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 42.3 ttp85 -55.09 -35.81 64.98 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 118.391 0.541 . . . . 0.0 111.249 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.63 -26.62 65.63 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 118.025 -0.988 . . . . 0.0 111.888 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -57.15 -39.47 75.27 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 121.115 1.78 . . . . 0.0 111.371 175.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 38.1 m -55.5 -28.22 53.31 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 119.948 1.249 . . . . 0.0 110.99 175.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.44 -20.58 67.84 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.409 1.481 . . . . 0.0 114.406 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 92.4 m -120.9 -6.96 9.55 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.909 1.284 . . . . 0.0 110.89 176.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -104.19 -24.96 13.1 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-O 118.247 -0.882 . . . . 0.0 113.169 -175.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -58.63 -24.04 60.28 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 121.248 1.84 . . . . 0.0 111.434 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -69.65 -41.25 75.82 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 120.197 1.362 . . . . 0.0 108.608 175.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 25.4 mt -57.5 -63.04 1.37 Allowed 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 126.193 1.797 . . . . 0.0 111.408 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.429 HG12 ' H ' ' A' ' 104' ' ' VAL . 0.9 OUTLIER -59.53 -29.65 42.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.059 176.142 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -72.14 -25.06 61.56 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-O 116.882 -1.532 . . . . 0.0 111.714 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -61.64 -38.53 88.03 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 122.061 2.209 . . . . 0.0 109.713 175.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 98.9 t -72.97 -60.37 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 175.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 39.3 t -77.79 26.45 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 129.153 2.981 . . . . 0.0 112.927 -175.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -57.19 -26.36 60.51 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 119.713 -1.867 . . . . 0.0 110.751 -177.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -84.3 72.49 10.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.92 1.288 . . . . 0.0 107.854 175.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -145.03 174.63 10.87 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 122.826 0.45 . . . . 0.0 110.878 176.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.35 -66.2 0.93 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 118.507 -0.759 . . . . 0.0 109.865 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.38 176.41 11.71 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.702 2.001 . . . . 0.0 108.721 178.095 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -106.4 173.5 6.29 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 123.568 0.747 . . . . 0.0 112.204 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.47 ' CD1' HD11 ' A' ' 117' ' ' ILE . 0.7 OUTLIER -143.4 155.04 44.29 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 103.126 -2.916 . . . . 0.0 103.126 -179.9 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 14.7 t -131.84 129.52 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 O-C-N 120.61 -1.306 . . . . 0.0 107.679 175.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.47 HD11 ' CD1' ' A' ' 115' ' ' PHE . 2.6 mp -133.97 148.1 30.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 125.509 1.524 . . . . 0.0 107.835 -178.059 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 7.7 p -130.85 -8.45 3.97 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.454 1.902 . . . . 0.0 113.966 -176.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -124.22 124.27 42.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -176.265 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.9 ttp85 -60.17 -30.56 69.41 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.316 -178.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -74.66 -26.18 59.69 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 119.83 1.195 . . . . 0.0 111.909 175.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.31 -40.54 43.95 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -177.166 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.426 HD11 ' CD1' ' A' ' 51' ' ' PHE . 2.3 tm? -45.18 -23.32 0.16 Allowed 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 130.195 3.398 . . . . 0.0 116.279 -175.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -48.15 130.54 15.88 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 125.476 1.51 . . . . 0.0 111.782 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -56.12 -16.48 5.19 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 176.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.262 30.2 t70 -58.1 -56.42 22.31 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 117.565 -1.207 . . . . 0.0 112.988 -175.701 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -77.09 -26.36 53.32 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 116.459 -2.096 . . . . 0.0 107.608 -175.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 51.4 mt -55.72 -40.84 62.77 Favored 'Isoleucine or valine' 0 C--N 1.343 0.302 0 C-N-CA 124.836 1.254 . . . . 0.0 108.331 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.2 mtmm -54.35 -52.17 62.43 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.915 0.779 . . . . 0.0 110.438 175.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 47.5 t -63.93 -44.25 93.43 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 117.962 -1.018 . . . . 0.0 109.47 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -63.85 -40.54 96.82 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.731 1.605 . . . . 0.0 110.687 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.44 -32.68 74.42 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.754 0.821 . . . . 0.0 109.358 175.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 46.3 mmtt -76.31 -38.53 55.9 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.412 1.485 . . . . 0.0 112.083 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -59.86 -57.24 13.73 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 125.998 1.719 . . . . 0.0 106.79 175.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.501 0 C-N-CA 123.461 0.705 . . . . 0.0 112.582 175.86 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 121.85 0.833 . . . . 0.0 111.533 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.634 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.8 m -111.9 171.92 7.21 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 128.06 2.544 . . . . 0.0 106.298 176.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.7 mmtp -140.48 178.99 6.92 Favored 'General case' 0 CA--C 1.513 -0.446 0 O-C-N 121.219 -0.926 . . . . 0.0 111.332 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.401 ' H ' HD13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -126.23 150.49 31.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 124.58 1.152 . . . . 0.0 109.441 179.243 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -95.05 83.42 3.93 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 101.759 -3.423 . . . . 0.0 101.759 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -61.99 -29.36 70.2 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 117.324 -1.322 . . . . 0.0 112.93 -175.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -69.09 -59.22 3.18 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.629 1.104 . . . . 0.0 108.346 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.62 95.68 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 122.667 0.387 . . . . 0.0 111.276 -176.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 85.7 m -73.97 -33.21 63.79 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.56 -0.733 . . . . 0.0 110.781 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.7 ttt-85 -63.92 -37.1 86.17 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 116.979 -1.486 . . . . 0.0 108.53 175.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.75 -46.91 87.71 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 120.351 1.432 . . . . 0.0 110.679 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.469 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -61.26 -50.78 71.67 Favored 'General case' 0 N--CA 1.462 0.137 0 O-C-N 121.553 -0.717 . . . . 0.0 111.523 176.431 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -51.39 -47.53 62.87 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.581 0.752 . . . . 0.0 110.293 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.89 -49.55 77.24 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.417 1.887 . . . . 0.0 111.0 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mp -59.52 -51.14 71.14 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 120.275 1.398 . . . . 0.0 111.205 175.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.415 ' CG2' HG23 ' A' ' 30' ' ' VAL . 79.2 t -60.93 -30.4 47.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 O-C-N 121.741 -0.599 . . . . 0.0 110.033 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.15 -38.74 60.87 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.375 1.07 . . . . 0.0 112.973 175.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -67.46 123.36 20.18 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -175.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.67 -32.16 68.85 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 124.666 1.186 . . . . 0.0 112.205 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.0 -11.47 82.51 Favored Glycine 0 CA--C 1.526 0.757 0 CA-C-O 119.374 -0.681 . . . . 0.0 112.45 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.0 t -81.19 123.62 28.6 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 118.961 1.381 . . . . 0.0 107.552 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.48 -23.89 62.77 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.608 175.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 t -67.23 123.69 20.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -108.32 -23.78 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 C-N-CA 124.315 1.046 . . . . 0.0 110.06 178.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.422 ' HB2' HG22 ' A' ' 65' ' ' VAL . 10.5 p-90 -131.05 138.99 49.86 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.802 0.841 . . . . 0.0 110.502 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.469 HG11 ' HB1' ' A' ' 16' ' ' ALA . 62.0 t -136.34 149.96 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 175.078 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.465 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 23.3 p -104.34 159.76 15.45 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 176.334 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -124.45 123.82 40.97 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 175.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -98.45 175.78 5.91 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 176.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -127.03 124.05 38.45 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 106.781 -1.562 . . . . 0.0 106.781 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -112.69 123.42 50.27 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 104.261 -2.496 . . . . 0.0 104.261 175.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 23.04 -88.86 0.01 OUTLIER Glycine 0 CA--C 1.529 0.961 0 C-N-CA 127.661 2.553 . . . . 0.0 116.683 -176.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 65.0 p -92.66 2.22 56.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.059 2.143 . . . . 0.0 116.175 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -150.63 175.83 11.57 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.233 1.379 . . . . 0.0 114.647 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 11.6 mm -93.69 136.26 25.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 128.036 2.534 . . . . 0.0 106.256 175.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.8 m -135.31 159.36 72.09 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-O 118.475 -0.774 . . . . 0.0 110.561 176.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.12 155.46 47.24 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 121.753 1.635 . . . . 0.0 110.288 175.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -120.45 -152.86 9.0 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 126.668 2.08 . . . . 0.0 109.728 176.232 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.42 164.97 5.11 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.491 1.117 . . . . 0.0 110.736 176.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -145.03 162.29 37.31 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.252 1.421 . . . . 0.0 110.127 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.72 176.7 42.91 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-O 122.055 0.809 . . . . 0.0 112.512 -179.052 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -125.46 -6.07 7.04 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.049 1.739 . . . . 0.0 111.965 -176.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.23 141.9 43.99 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 -177.17 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -83.89 -14.52 50.87 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -174.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -60.56 -36.11 77.68 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 119.885 -1.76 . . . . 0.0 109.564 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -71.7 -22.76 61.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.323 1.049 . . . . 0.0 112.034 175.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -67.09 -43.57 82.2 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.339 1.056 . . . . 0.0 109.522 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.0 mm -54.32 -47.24 69.3 Favored 'Isoleucine or valine' 0 C--N 1.342 0.245 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -176.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.3 mm-40 -65.03 -23.93 67.34 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.53 0.732 . . . . 0.0 112.502 -176.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -77.39 -24.26 50.56 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 119.444 1.02 . . . . 0.0 111.359 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.2 m -73.83 113.62 11.19 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.07 -1.455 . . . . 0.0 107.07 177.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.31 2.1 p -100.73 178.39 4.72 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.892 1.277 . . . . 0.0 110.594 -176.816 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.09 -76.15 0.1 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 117.951 2.574 . . . . 0.0 117.951 -174.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.39 -27.8 19.09 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 120.226 1.375 . . . . 0.0 114.569 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.7 m -70.63 169.66 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 120.895 -1.128 . . . . 0.0 112.165 -175.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.441 ' H ' ' HD3' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -121.3 144.77 48.45 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.805 1.242 . . . . 0.0 107.986 178.059 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.9 tp -146.79 166.63 26.06 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.058 1.743 . . . . 0.0 107.702 -176.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -133.08 157.82 44.31 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 176.058 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.71 153.51 41.06 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 118.744 0.702 . . . . 0.0 111.139 175.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.403 ' CE1' ' HB3' ' A' ' 79' ' ' PHE . 54.7 t80 -119.86 123.64 44.12 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 104.536 -2.394 . . . . 0.0 104.536 175.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.422 HG22 ' HB2' ' A' ' 29' ' ' TRP . 39.3 t -135.15 138.72 48.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 O-C-N 123.222 0.326 . . . . 0.0 110.209 -175.202 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.7 ttm180 -75.41 117.85 17.65 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.639 1.976 . . . . 0.0 106.949 175.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -131.88 150.92 52.01 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 84.7 m . . . . . 0 N--CA 1.453 -0.308 0 O-C-N 121.517 -0.74 . . . . 0.0 111.153 -175.668 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.2 m . . . . . 0 N--CA 1.447 -0.582 0 CA-C-O 121.466 0.65 . . . . 0.0 109.845 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.416 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 2.4 mptp? -55.78 143.35 31.34 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.379 0.671 . . . . 0.0 109.585 177.264 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -119.38 162.46 18.76 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 t -139.55 151.73 46.32 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.3 mttp -146.39 175.81 10.26 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.686 1.995 . . . . 0.0 107.076 176.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.403 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . 92.1 m-85 -140.26 134.69 31.4 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 175.266 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -104.83 114.26 28.36 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 124.877 1.361 . . . . 0.0 107.401 177.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -83.47 113.53 20.84 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 102.339 -3.208 . . . . 0.0 102.339 175.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 mt -96.75 142.66 13.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 -176.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.3 m -125.59 123.46 39.08 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 104.382 -2.451 . . . . 0.0 104.382 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 39.5 t-105 -103.06 124.28 48.24 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 104.825 -2.287 . . . . 0.0 104.825 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 mm -125.54 110.06 23.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 103.562 -2.755 . . . . 0.0 103.562 175.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.441 ' O ' HG12 ' A' ' 89' ' ' VAL . . . -54.96 126.8 39.54 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 107.643 -2.183 . . . . 0.0 107.643 175.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.53 -12.25 2.58 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 118.786 1.293 . . . . 0.0 112.833 -175.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -83.77 -30.68 26.43 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 117.324 -1.322 . . . . 0.0 111.401 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.441 HG12 ' O ' ' A' ' 86' ' ' GLY . 8.4 p -74.14 143.82 13.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 121.083 1.765 . . . . 0.0 111.392 -175.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.0 t -143.16 176.69 8.93 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.463 1.905 . . . . 0.0 106.938 175.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 79.58 -156.32 40.65 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 176.006 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.0 tt -59.27 -42.52 91.41 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.404 1.081 . . . . 0.0 112.535 -175.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -33.62 73.86 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 120.706 1.594 . . . . 0.0 111.536 -176.378 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.31 -50.33 27.83 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 175.469 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.34 -27.02 67.03 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 125.17 1.388 . . . . 0.0 113.41 -176.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -46.26 -41.32 12.85 Favored 'General case' 0 CA--C 1.502 -0.889 0 C-N-CA 124.489 1.116 . . . . 0.0 110.205 175.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.2 m -52.79 -39.6 62.47 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.422 1.089 . . . . 0.0 111.144 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -74.86 -10.31 83.59 Favored Glycine 0 CA--C 1.532 1.146 0 O-C-N 121.351 -0.843 . . . . 0.0 113.612 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 47.2 m -112.46 -15.14 13.15 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.358 1.863 . . . . 0.0 110.763 177.009 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -104.31 -29.33 10.85 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 126.504 1.921 . . . . 0.0 112.898 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -54.41 -33.04 58.59 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 119.901 1.228 . . . . 0.0 112.885 177.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.8 t -63.95 -34.19 77.43 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 118.842 0.746 . . . . 0.0 111.412 176.261 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.634 HD11 ' HB ' ' A' ' 6' ' ' THR . 30.8 mt -67.76 -61.82 1.7 Allowed 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 125.678 1.591 . . . . 0.0 109.478 -175.704 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -58.67 -33.33 48.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-O 118.147 -0.93 . . . . 0.0 109.173 175.512 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 63.0 tttt -64.92 -42.07 95.03 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 120.481 1.491 . . . . 0.0 110.232 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.78 -26.06 61.4 Favored 'General case' 0 C--N 1.335 -0.048 0 CA-C-N 119.146 0.885 . . . . 0.0 111.952 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 69.7 t -84.27 -61.74 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 175.548 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.05 26.53 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 129.843 3.257 . . . . 0.0 113.448 -175.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -50.54 -26.78 5.61 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 119.895 -1.753 . . . . 0.0 112.491 -176.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -88.75 74.49 8.33 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 175.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -140.04 161.0 38.66 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 175.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -87.49 -66.83 0.87 Allowed 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.201 -176.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.99 176.34 12.32 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 129.615 3.166 . . . . 0.0 108.698 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -119.89 165.73 14.24 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.345 1.058 . . . . 0.0 112.74 -175.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -133.94 147.31 51.05 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 104.311 -2.478 . . . . 0.0 104.311 -175.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.8 t -123.14 129.52 74.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 176.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -132.9 141.14 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 125.26 1.424 . . . . 0.0 107.752 -176.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 p -139.38 -2.26 1.63 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 175.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -129.07 151.35 49.85 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 124.512 1.125 . . . . 0.0 110.182 178.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 40.8 ttp-105 -58.19 -45.43 87.59 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 123.103 0.561 . . . . 0.0 110.881 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -65.66 -23.48 66.8 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.65 0.659 . . . . 0.0 110.539 -176.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -83.37 -23.25 32.53 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.9 2.08 . . . . 0.0 110.986 175.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -77.35 -23.29 50.9 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.692 1.597 . . . . 0.0 112.536 178.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 -63.4 123.78 19.59 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -175.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -49.69 -25.25 2.77 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 119.28 3.067 . . . . 0.0 119.28 175.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -63.33 -56.26 17.83 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 119.335 0.971 . . . . 0.0 113.154 -175.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -78.37 -26.09 46.52 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 118.0 -1.48 . . . . 0.0 109.152 -177.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 19.4 mt -52.7 -40.5 34.81 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 C-N-CA 124.899 1.28 . . . . 0.0 108.926 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 33.8 mttp -54.8 -49.49 70.84 Favored 'General case' 0 N--CA 1.457 -0.075 0 CA-C-N 118.213 0.46 . . . . 0.0 111.766 176.009 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 35.1 t -72.0 -36.31 69.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.059 0.544 . . . . 0.0 111.379 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.15 -46.03 91.05 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 119.466 1.03 . . . . 0.0 108.603 176.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 74.1 mt -66.6 -23.92 66.25 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 123.849 0.86 . . . . 0.0 110.883 175.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 16.1 mttt -73.0 -47.81 41.88 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 120.413 1.461 . . . . 0.0 107.182 175.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -61.44 -60.78 3.19 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.716 0.806 . . . . 0.0 109.036 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.527 0 C-N-CA 125.087 1.355 . . . . 0.0 112.124 175.824 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.307 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.9 m -142.99 158.27 43.76 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.608 1.563 . . . . 0.0 106.962 -175.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -132.66 -171.73 2.73 Favored 'General case' 0 CA--C 1.518 -0.282 0 O-C-N 121.273 -0.892 . . . . 0.0 111.92 -175.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.9 152.9 33.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 C-N-CA 124.388 1.075 . . . . 0.0 110.913 176.462 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -99.78 85.0 3.0 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 100.601 -3.851 . . . . 0.0 100.601 174.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -61.24 -24.3 66.27 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 117.166 -1.397 . . . . 0.0 112.54 -175.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -76.95 -54.18 6.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 120.786 1.63 . . . . 0.0 109.205 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.11 -36.33 83.23 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.768 -0.583 . . . . 0.0 111.043 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 79.5 m -75.56 -38.84 58.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 118.966 -0.54 . . . . 0.0 111.526 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.7 ttt-85 -60.06 -34.53 73.55 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-O 116.789 -1.577 . . . . 0.0 109.024 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.87 -56.6 18.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 120.596 1.544 . . . . 0.0 110.509 -177.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.656 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -61.42 -43.69 98.44 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 118.507 0.594 . . . . 0.0 111.751 179.034 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -55.24 -44.19 75.27 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -59.51 -41.95 91.11 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.327 1.451 . . . . 0.0 111.105 -176.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.37 -60.99 2.77 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 123.984 0.802 . . . . 0.0 109.88 175.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.498 ' CG2' HG23 ' A' ' 30' ' ' VAL . 71.0 t -59.06 -31.64 46.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 122.978 0.511 . . . . 0.0 111.58 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -37.25 86.92 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 125.872 1.669 . . . . 0.0 110.769 176.024 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -81.59 123.21 28.48 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 124.013 0.821 . . . . 0.0 109.68 -176.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.13 -17.87 64.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 118.596 -0.716 . . . . 0.0 112.884 175.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.28 -12.44 80.67 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.737 1.16 . . . . 0.0 113.061 176.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.1 t -80.06 137.9 36.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 119.559 1.68 . . . . 0.0 109.038 -177.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -74.34 -18.59 60.67 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.233 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.0 t -82.45 123.83 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 106.495 -1.668 . . . . 0.0 106.495 176.287 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -113.64 -23.65 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.66 -178.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 26.5 p-90 -129.48 135.49 48.7 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.636 0.774 . . . . 0.0 109.19 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.656 HG11 ' HB1' ' A' ' 16' ' ' ALA . 33.4 t -136.03 166.34 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 175.392 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 65.1 p -123.55 161.67 24.48 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.946 0.898 . . . . 0.0 109.757 175.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -128.18 123.7 34.98 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 175.493 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -95.21 176.16 6.33 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 178.014 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -122.53 140.35 52.87 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -142.12 143.46 33.03 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.728 1.611 . . . . 0.0 107.219 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 36.62 -104.69 0.03 OUTLIER Glycine 0 CA--C 1.528 0.857 0 C-N-CA 126.281 1.896 . . . . 0.0 113.55 -177.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.7 p -125.08 33.53 5.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.629 1.572 . . . . 0.0 111.224 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.2 t -142.78 175.85 9.51 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 122.022 0.915 . . . . 0.0 111.812 176.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.5 mm -102.92 137.96 29.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 126.035 1.734 . . . . 0.0 106.432 177.004 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.13 165.28 33.4 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 123.78 0.832 . . . . 0.0 109.583 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.78 168.33 24.86 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 121.842 1.695 . . . . 0.0 111.607 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.24 -170.74 12.08 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 126.495 1.998 . . . . 0.0 109.472 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -61.33 161.8 8.65 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.105 1.362 . . . . 0.0 111.215 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -145.13 174.11 11.34 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.06 1.344 . . . . 0.0 111.336 -178.151 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.39 -175.92 42.35 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 124.074 0.845 . . . . 0.0 111.568 177.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.96 -26.61 6.82 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 125.941 1.696 . . . . 0.0 110.134 175.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -108.15 130.47 55.12 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -82.96 -10.3 58.86 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -174.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 42.1 tt0 -54.09 -39.34 66.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 120.746 1.612 . . . . 0.0 111.156 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -56.93 -38.6 73.11 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.929 1.292 . . . . 0.0 111.769 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -59.0 -37.62 77.3 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.743 1.217 . . . . 0.0 108.525 -177.068 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.8 mm -61.96 -49.76 82.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -175.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -66.72 -32.42 73.71 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.52 0.6 . . . . 0.0 111.817 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -60.83 -38.89 87.01 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-O 118.786 -0.626 . . . . 0.0 111.192 -176.283 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.3 m -57.75 118.68 5.54 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.049 0.94 . . . . 0.0 110.442 -176.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.505 ' OG1' HG22 ' A' ' 59' ' ' VAL . 2.5 p -83.92 -173.9 4.98 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 129.28 3.032 . . . . 0.0 111.943 -176.614 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 19.9 p-10 -78.34 -70.29 0.5 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.112 0.965 . . . . 0.0 111.553 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -106.24 -36.34 6.9 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.378 1.871 . . . . 0.0 113.807 -175.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.505 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -60.41 129.86 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -175.399 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.82 141.95 35.23 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.289 1.835 . . . . 0.0 106.19 -175.477 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 tp -142.5 169.36 17.71 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.56 1.144 . . . . 0.0 110.892 -174.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.662 ' CZ ' HG23 ' A' ' 97' ' ' THR . 11.3 m-85 -124.43 143.57 50.55 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.025 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -128.0 147.72 50.51 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 125.723 1.609 . . . . 0.0 110.331 176.587 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -121.31 124.06 43.67 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 104.394 -2.447 . . . . 0.0 104.394 177.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.5 t -136.8 143.6 34.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 O-C-N 123.358 0.411 . . . . 0.0 110.804 -175.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.3 119.04 25.23 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.315 1.446 . . . . 0.0 107.517 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -136.39 126.93 26.92 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.451 1.1 . . . . 0.0 109.048 -176.065 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.5 m . . . . . 0 C--N 1.325 -0.472 0 C-N-CA 124.591 1.157 . . . . 0.0 110.169 -175.711 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.45 -0.465 0 CA-C-O 121.338 0.59 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -71.34 149.29 46.22 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 105.353 -2.092 . . . . 0.0 105.353 175.051 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -133.63 154.56 50.81 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 175.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.2 t -145.09 128.76 17.17 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -135.3 175.7 9.34 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -138.89 141.21 38.57 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.291 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -115.87 134.18 55.26 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 125.899 1.68 . . . . 0.0 107.438 -178.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -102.92 113.57 27.12 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 175.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mp -107.13 138.73 31.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 -175.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.3 m -121.32 123.47 42.24 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 104.766 -2.309 . . . . 0.0 104.766 -177.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -93.02 123.35 36.21 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 176.06 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.575 HD11 HG21 ' A' ' 97' ' ' THR . 5.9 mm -145.45 85.46 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 -177.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.655 ' O ' HG12 ' A' ' 89' ' ' VAL . . . -56.25 153.91 16.64 Favored Glycine 0 CA--C 1.532 1.136 0 O-C-N 121.551 -0.718 . . . . 0.0 112.205 -175.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -61.57 -19.44 62.17 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.565 -1.55 . . . . 0.0 112.132 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -83.36 -13.59 54.65 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 121.103 -0.998 . . . . 0.0 111.715 -176.116 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.655 HG12 ' O ' ' A' ' 86' ' ' GLY . 12.7 p -72.64 131.93 34.12 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-N 120.001 1.273 . . . . 0.0 110.007 179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.8 t -60.14 149.46 32.66 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.95 0.9 . . . . 0.0 109.367 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.53 -26.5 59.75 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.2 tt -68.89 -51.11 43.59 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 119.201 1.5 . . . . 0.0 110.668 177.202 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 19.9 mp0 -60.99 -38.82 87.35 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.315 -0.866 . . . . 0.0 109.5 175.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -61.62 -32.5 72.64 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.753 0.821 . . . . 0.0 111.248 175.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.79 -23.87 67.38 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.394 177.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.46 -54.05 50.24 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.913 1.688 . . . . 0.0 107.885 175.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.662 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 58.6 m -51.99 -38.22 55.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.864 0.866 . . . . 0.0 108.892 175.432 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -57.89 -19.87 38.67 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.067 1.318 . . . . 0.0 115.413 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 10.8 m -119.15 -2.94 10.64 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.816 1.808 . . . . 0.0 111.283 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -103.03 -23.7 13.67 Favored 'General case' 0 CA--C 1.516 -0.334 0 O-C-N 121.107 -0.995 . . . . 0.0 112.897 -175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -49.77 -39.23 37.26 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.495 1.498 . . . . 0.0 112.604 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.8 t -59.87 -30.48 69.02 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.368 0.531 . . . . 0.0 111.753 -179.193 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.4 mt -64.47 -63.36 1.15 Allowed 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 124.562 1.145 . . . . 0.0 109.014 -178.56 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.436 HG12 ' H ' ' A' ' 104' ' ' VAL 0.251 0.9 OUTLIER -59.29 -29.38 41.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 118.603 -0.713 . . . . 0.0 109.655 175.83 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -63.32 -47.25 83.01 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 120.104 1.32 . . . . 0.0 109.017 175.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -52.42 -30.67 30.56 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.103 1.361 . . . . 0.0 111.92 -178.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 91.9 t -84.02 -54.41 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.054 0.942 . . . . 0.0 109.682 176.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 47.6 t -86.32 26.12 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 127.39 2.276 . . . . 0.0 114.081 -175.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -53.1 -26.55 16.78 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 119.749 -1.844 . . . . 0.0 114.752 -175.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -91.4 83.52 5.45 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -145.65 175.4 10.4 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 126.135 1.774 . . . . 0.0 107.759 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -101.95 -66.21 0.94 Allowed 'General case' 0 C--O 1.234 0.275 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -175.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -144.35 172.52 12.82 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 125.043 1.337 . . . . 0.0 109.598 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -126.59 168.37 14.4 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.159 0.984 . . . . 0.0 110.647 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -148.44 157.59 43.57 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 105.302 -2.11 . . . . 0.0 105.302 -175.202 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.4 t -131.8 124.19 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -123.92 141.53 43.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -179.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.3 p -129.26 3.2 5.17 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.517 1.127 . . . . 0.0 113.726 -176.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -137.73 124.56 21.2 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.693 1.197 . . . . 0.0 108.363 -175.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -64.56 -25.02 67.8 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.842 0.857 . . . . 0.0 112.189 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 32.6 mtmt -74.24 -47.32 35.98 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 119.973 1.261 . . . . 0.0 108.438 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -59.84 -39.17 84.22 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.622 -0.704 . . . . 0.0 111.662 178.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -44.04 -23.19 0.08 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 130.768 3.627 . . . . 0.0 115.554 -175.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -46.42 135.79 7.94 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 126.095 1.758 . . . . 0.0 109.68 175.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -63.87 -14.06 50.21 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 121.569 -0.707 . . . . 0.0 112.653 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -57.8 -55.32 36.44 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 119.168 0.895 . . . . 0.0 110.446 -176.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.33 -26.68 60.3 Favored 'General case' 0 C--N 1.351 0.657 0 C-N-CA 115.488 -2.485 . . . . 0.0 109.383 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 69.4 mt -60.41 -46.02 95.81 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -56.79 -52.69 64.05 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.31 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 34.1 t -61.85 -41.81 98.27 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.737 0.698 . . . . 0.0 110.335 -177.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -62.95 -51.31 67.38 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 123.668 0.787 . . . . 0.0 109.749 177.246 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 98.0 mt -63.7 -31.5 72.69 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.289 -1.507 . . . . 0.0 111.628 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -47.98 75.66 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.515 1.526 . . . . 0.0 107.953 175.462 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 46.9 mttm -62.02 -41.59 98.25 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.821 0.848 . . . . 0.0 109.234 175.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.219 0 C-N-CA 125.818 1.647 . . . . 0.0 112.98 -176.299 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.638 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.591 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.5 m -135.81 168.89 18.46 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 175.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -133.86 -178.31 4.96 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.556 -1.34 . . . . 0.0 112.662 -178.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.24 151.37 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 124.498 1.119 . . . . 0.0 108.933 178.024 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -93.61 77.41 4.34 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 101.881 -3.377 . . . . 0.0 101.881 174.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.77 -24.45 65.77 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.966 -1.016 . . . . 0.0 112.85 -175.161 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -70.24 -56.48 6.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 119.641 1.11 . . . . 0.0 109.128 -175.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.52 86.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.56 0.344 . . . . 0.0 110.488 176.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.1 m -64.99 -36.09 83.28 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.727 -0.608 . . . . 0.0 111.501 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -61.24 -35.0 76.04 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 117.461 -1.257 . . . . 0.0 110.092 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.55 -53.21 59.35 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 120.248 1.385 . . . . 0.0 110.541 -178.149 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.553 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -64.63 -41.02 96.44 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.752 0.706 . . . . 0.0 111.261 178.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -56.79 -39.08 73.46 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.268 1.027 . . . . 0.0 110.057 177.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -66.67 -46.32 76.05 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 126.141 1.776 . . . . 0.0 110.785 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.5 mp -58.62 -52.76 64.3 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 118.784 0.72 . . . . 0.0 112.001 175.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.487 ' CG2' HG23 ' A' ' 30' ' ' VAL . 31.5 t -63.52 -36.51 76.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 118.777 0.717 . . . . 0.0 110.603 -179.575 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.4 ttm-85 -63.7 -37.52 87.66 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 118.817 -0.611 . . . . 0.0 110.308 175.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -75.44 141.09 43.23 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.28 1.032 . . . . 0.0 113.189 -175.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -86.33 -11.85 50.99 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 126.448 1.899 . . . . 0.0 112.87 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -88.14 -35.8 8.67 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.0 t -54.39 138.45 39.69 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.892 1.677 . . . . 0.0 108.74 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.6 -35.52 60.52 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 175.491 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.8 t -63.08 127.22 22.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 C-N-CA 125.971 1.709 . . . . 0.0 109.99 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.5 pp -114.96 -23.83 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 126.489 1.916 . . . . 0.0 111.874 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 42.6 p-90 -126.27 148.86 49.42 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 119.577 1.08 . . . . 0.0 109.015 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.553 HG21 ' HB1' ' A' ' 16' ' ' ALA . 6.4 t -140.02 161.35 26.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 127.356 2.262 . . . . 0.0 106.682 176.215 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 17.2 p -124.07 156.73 36.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -132.5 124.7 29.02 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.127 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -110.32 176.47 5.04 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 -176.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.434 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 36.0 m-85 -123.28 136.5 54.72 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -176.661 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -148.76 124.03 10.21 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 175.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 54.95 -128.59 43.83 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 p -86.73 9.78 17.84 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.8 t -143.56 171.77 13.71 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 120.228 1.376 . . . . 0.0 114.604 -175.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.434 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 51.0 mm -90.76 137.13 22.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 101.826 -3.398 . . . . 0.0 101.826 174.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.1 m -121.83 158.95 53.17 Favored Pre-proline 0 C--O 1.236 0.376 0 C-N-CA 123.521 0.728 . . . . 0.0 110.132 176.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.19 154.61 61.82 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 121.167 1.245 . . . . 0.0 110.139 175.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.83 -171.31 15.0 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 127.295 2.379 . . . . 0.0 109.213 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -64.67 167.51 7.22 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 122.186 -0.597 . . . . 0.0 110.407 175.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -149.69 162.14 40.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.998 1.319 . . . . 0.0 109.02 -177.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.36 177.37 48.3 Favored Glycine 0 CA--C 1.524 0.615 0 CA-C-N 117.999 0.363 . . . . 0.0 112.227 -176.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.94 -7.23 17.1 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.222 1.409 . . . . 0.0 113.726 -175.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.6 137.93 45.71 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.737 1.215 . . . . 0.0 108.913 -175.577 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -84.54 -10.84 57.06 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 -175.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -61.45 -42.85 99.4 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 119.85 -1.781 . . . . 0.0 111.894 -176.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 75.4 m80 -68.96 -22.71 64.1 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.016 0.825 . . . . 0.0 111.393 178.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -61.83 -31.43 71.67 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 120.658 -1.277 . . . . 0.0 111.75 177.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.449 ' HA ' HD12 ' A' ' 123' ' ' LEU . 6.4 mm -62.03 -34.42 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -82.9 -32.64 27.21 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 117.834 -1.079 . . . . 0.0 110.099 175.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -53.82 -42.86 68.87 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 120.007 1.276 . . . . 0.0 111.081 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 76.5 m -60.89 113.42 2.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.415 ' OG1' HG22 ' A' ' 59' ' ' VAL . 2.3 p -83.62 176.93 8.65 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.466 1.506 . . . . 0.0 110.915 -176.475 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -72.19 -58.24 3.58 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 117.813 2.523 . . . . 0.0 117.813 -175.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -106.2 -35.51 7.17 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 117.181 2.289 . . . . 0.0 117.181 -174.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.415 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.7 m -67.77 173.37 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 123.007 1.384 . . . . 0.0 112.213 -175.328 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.8 ptt-85 -111.35 135.97 51.14 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 175.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.2 tp -134.48 162.15 33.05 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -131.99 147.23 52.44 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.141 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -139.38 126.97 21.75 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.37 0.668 . . . . 0.0 110.665 -178.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.415 ' CD1' HG13 ' A' ' 108' ' ' VAL . 37.6 t80 -95.65 123.36 39.17 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 101.933 -3.358 . . . . 0.0 101.933 175.215 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.2 t -135.09 136.17 51.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -175.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.2 ttm-85 -75.71 130.49 38.77 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.86 1.664 . . . . 0.0 106.853 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -136.28 157.92 45.66 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.251 1.02 . . . . 0.0 109.407 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.0 m . . . . . 0 CA--C 1.533 0.295 0 O-C-N 120.77 -1.206 . . . . 0.0 109.973 -176.116 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.446 -0.674 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.5 mmtt -71.13 164.93 24.64 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 175.402 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.3 mtp180 -131.59 168.62 17.38 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 -177.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.8 t -145.4 132.93 20.82 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.162 -1.422 . . . . 0.0 107.162 175.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp -123.48 176.08 6.39 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.761 2.024 . . . . 0.0 107.49 -177.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -141.89 143.73 33.46 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 176.434 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -119.91 133.32 55.61 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 177.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -97.71 113.12 24.81 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 175.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mp -99.38 144.0 12.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -125.32 123.6 39.77 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 104.737 -2.32 . . . . 0.0 104.737 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.1 t-105 -100.68 131.89 46.35 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 175.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.0 mt -136.27 108.92 8.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 175.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.97 134.65 22.33 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 175.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.81 -7.01 9.42 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.179 -1.189 . . . . 0.0 113.112 -175.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -83.65 -23.63 31.72 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 120.188 -1.57 . . . . 0.0 112.96 176.523 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 14.2 p -85.82 123.02 39.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 120.921 1.691 . . . . 0.0 110.974 -175.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 25.3 t -146.67 124.14 11.7 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 175.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.72 -167.17 27.2 Favored Glycine 0 C--O 1.24 0.494 0 N-CA-C 107.562 -2.215 . . . . 0.0 107.562 -175.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.0 tt -53.68 -39.36 65.07 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 117.915 0.857 . . . . 0.0 109.899 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -57.03 -36.22 70.21 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.389 0.995 . . . . 0.0 111.248 -176.532 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.25 -49.58 27.0 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.595 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.18 -24.04 51.7 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.525 1.13 . . . . 0.0 112.844 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -50.24 -45.01 53.68 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 124.764 1.225 . . . . 0.0 109.384 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.4 m -55.09 -39.13 68.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 118.891 0.769 . . . . 0.0 110.886 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.05 -26.12 74.14 Favored Glycine 0 CA--C 1.526 0.737 0 CA-C-N 119.164 0.893 . . . . 0.0 112.717 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 99.7 m -94.48 -17.92 21.97 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.995 1.718 . . . . 0.0 111.223 177.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -104.25 -23.56 13.22 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 126.201 1.8 . . . . 0.0 115.178 -174.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -52.46 -27.86 17.85 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 120.817 1.644 . . . . 0.0 113.902 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -62.64 -43.78 97.94 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.827 1.194 . . . . 0.0 109.404 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.591 HD11 ' HB ' ' A' ' 6' ' ' THR . 18.7 mt -55.2 -65.3 0.61 Allowed 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 125.774 1.63 . . . . 0.0 110.758 -175.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.406 HG12 ' H ' ' A' ' 104' ' ' VAL 0.288 0.8 OUTLIER -58.88 -28.67 38.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.564 176.196 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.8 tttm -69.24 -35.37 76.07 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 121.017 1.735 . . . . 0.0 110.312 175.459 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -57.71 -28.91 64.27 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 120.327 1.421 . . . . 0.0 110.366 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 89.3 t -79.97 -64.44 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 175.222 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.415 HG13 ' CD1' ' A' ' 64' ' ' PHE . 86.8 t -67.06 25.35 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 130.069 3.348 . . . . 0.0 114.431 -175.494 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -55.35 -26.6 41.92 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 118.884 -2.385 . . . . 0.0 115.217 -175.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -92.65 83.71 4.92 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 175.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -147.03 166.14 27.74 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.119 0.485 . . . . 0.0 109.702 175.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.72 -66.49 0.92 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.922 1.289 . . . . 0.0 110.04 -175.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -145.97 176.31 9.79 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 127.903 2.481 . . . . 0.0 109.592 175.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -117.14 167.48 11.15 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.693 1.197 . . . . 0.0 110.789 177.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -146.51 148.68 32.46 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -175.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 48.2 t -126.95 127.06 69.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 175.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mp -129.44 142.56 43.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 N-CA-C 106.348 -1.723 . . . . 0.0 106.348 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 p -130.08 -0.75 4.66 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.422 ' OD1' ' HE3' ' A' ' 121' ' ' LYS . 31.4 t0 -118.78 124.14 46.53 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.227 0.921 . . . . 0.0 109.267 176.448 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -65.63 -24.33 67.02 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.802 0.841 . . . . 0.0 111.189 -176.225 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.422 ' HE3' ' OD1' ' A' ' 119' ' ' ASP . 24.2 mtmt -76.45 -32.5 58.45 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.087 1.355 . . . . 0.0 110.017 175.206 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.61 -35.17 45.99 Favored 'General case' 0 C--O 1.215 -0.742 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.449 HD12 ' HA ' ' A' ' 52' ' ' ILE . 3.0 tm? -44.5 -23.14 0.1 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 131.173 3.789 . . . . 0.0 114.993 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -45.64 140.35 3.41 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.616 1.966 . . . . 0.0 110.374 175.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -64.76 -14.65 59.7 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.384 -0.823 . . . . 0.0 111.981 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -54.13 -52.41 61.16 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 118.228 -0.892 . . . . 0.0 112.793 -175.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -85.72 -26.23 26.0 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 117.034 -1.866 . . . . 0.0 109.0 -176.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 47.0 mt -58.64 -48.11 86.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -54.71 -54.54 40.47 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.513 -0.756 . . . . 0.0 110.467 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 29.8 t -60.67 -39.3 87.89 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.124 0.874 . . . . 0.0 110.299 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -68.96 -45.04 71.7 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.703 -0.623 . . . . 0.0 110.752 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.4 -33.56 76.16 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.319 1.048 . . . . 0.0 111.18 176.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -66.33 -51.51 56.54 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.444 1.498 . . . . 0.0 108.164 175.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -56.08 -45.07 79.48 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.237 0.926 . . . . 0.0 109.05 175.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.375 0 C-N-CA 124.876 1.27 . . . . 0.0 114.156 179.563 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.401 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.606 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.5 m -68.04 162.66 24.07 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 175.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -132.33 -179.35 5.38 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 120.964 -1.085 . . . . 0.0 109.282 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.47 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -139.82 150.53 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 124.795 1.238 . . . . 0.0 109.063 178.766 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -96.74 79.92 3.01 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 102.012 -3.329 . . . . 0.0 102.012 174.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -65.95 -24.24 66.77 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 117.819 -1.086 . . . . 0.0 112.953 -175.295 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -66.41 -56.11 12.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 176.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.83 -45.15 87.37 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 122.065 -0.397 . . . . 0.0 111.303 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.654 ' HB3' HG11 ' A' ' 107' ' ' VAL . 17.6 m -60.6 -40.37 91.55 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 118.484 -0.77 . . . . 0.0 111.224 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -62.21 -32.87 73.58 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.586 178.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.33 9.07 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 120.242 1.383 . . . . 0.0 110.014 176.3 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.452 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -54.45 -48.36 71.81 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.823 -0.548 . . . . 0.0 111.828 178.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -52.86 -48.59 66.96 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 124.004 0.922 . . . . 0.0 110.436 175.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.69 -43.83 98.1 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 117.1 -1.429 . . . . 0.0 110.677 -178.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.6 mp -58.01 -60.53 3.58 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 119.483 1.038 . . . . 0.0 109.534 175.3 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.467 ' CG2' HG23 ' A' ' 30' ' ' VAL . 43.9 t -59.74 -31.64 47.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 121.846 -0.534 . . . . 0.0 111.407 -176.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -73.33 -26.7 61.15 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.437 -0.79 . . . . 0.0 111.296 176.007 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -80.15 123.73 28.16 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.22 0.918 . . . . 0.0 110.025 -176.34 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.28 -23.0 67.15 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 123.66 0.784 . . . . 0.0 110.367 175.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.13 -3.87 88.67 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.075 1.798 . . . . 0.0 114.303 177.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.3 t -85.77 130.64 34.5 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.766 1.783 . . . . 0.0 109.608 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.6 -35.98 75.79 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 175.264 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 t -63.17 131.04 28.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -114.39 -23.6 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 126.034 1.733 . . . . 0.0 110.503 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.472 ' HB2' HG22 ' A' ' 65' ' ' VAL . 37.5 p-90 -131.09 141.77 50.2 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.296 1.039 . . . . 0.0 111.092 178.454 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.467 HG23 ' CG2' ' A' ' 20' ' ' VAL . 61.2 t -137.1 147.22 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 175.103 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.468 HG22 ' HB2' ' A' ' 63' ' ' ALA . 40.3 p -103.8 162.43 13.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.082 0.468 . . . . 0.0 109.83 178.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -134.32 141.82 47.05 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.768 1.627 . . . . 0.0 107.132 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -124.82 176.82 6.36 Favored 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 125.356 1.463 . . . . 0.0 107.569 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -113.9 145.05 42.04 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.456 0.646 . . . . 0.0 110.312 176.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -129.92 123.46 30.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 103.408 -2.812 . . . . 0.0 103.408 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 38.05 -94.28 0.01 OUTLIER Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.26 1.41 . . . . 0.0 113.883 -176.249 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.4 p -124.71 34.51 4.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.142 1.777 . . . . 0.0 112.994 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -144.71 172.86 12.41 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.321 1.048 . . . . 0.0 112.194 175.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.4 mm -98.4 132.35 43.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 C-N-CA 125.455 1.502 . . . . 0.0 107.028 176.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.5 m -120.65 160.52 43.94 Favored Pre-proline 0 C--O 1.235 0.327 0 C-N-CA 124.879 1.272 . . . . 0.0 110.251 175.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.02 160.88 44.85 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 120.971 1.114 . . . . 0.0 110.84 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -128.87 -173.11 13.33 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 106.837 -2.505 . . . . 0.0 106.837 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -69.8 171.59 8.98 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.822 -0.811 . . . . 0.0 111.212 177.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 -142.11 171.63 13.8 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.085 1.354 . . . . 0.0 111.749 -175.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.99 167.7 39.91 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-O 122.085 0.825 . . . . 0.0 112.695 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.93 -9.05 13.66 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 127.529 2.332 . . . . 0.0 112.474 -175.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.23 144.9 45.1 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 104.964 -2.235 . . . . 0.0 104.964 -177.4 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -84.06 -15.85 45.99 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -175.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -58.19 -37.22 74.35 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 120.916 1.689 . . . . 0.0 110.138 -178.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -73.38 -21.8 60.42 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.328 -0.857 . . . . 0.0 112.189 176.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -62.1 -46.47 88.91 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 120.423 1.465 . . . . 0.0 109.535 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.4 mp -61.39 -37.69 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.094 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -65.59 -39.04 91.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 122.668 0.387 . . . . 0.0 111.368 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -73.13 -24.02 60.55 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 126.543 1.937 . . . . 0.0 114.729 -175.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 85.1 m -63.67 118.12 7.8 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.289 2.3 p -82.72 163.2 21.47 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 122.662 1.22 . . . . 0.0 111.458 -175.712 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -46.6 -75.48 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 130.655 3.582 . . . . 0.0 115.949 -175.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -102.04 -36.63 8.51 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -175.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 18.5 m -62.12 166.98 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 -175.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -107.42 135.17 49.35 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 175.424 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.4 tp -132.29 170.82 14.51 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.179 1.792 . . . . 0.0 108.585 -175.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -136.33 157.03 47.77 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 124.537 1.135 . . . . 0.0 108.354 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.468 ' HB2' HG22 ' A' ' 31' ' ' THR . . . -152.67 129.71 11.09 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 119.17 0.895 . . . . 0.0 112.875 175.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -89.78 123.52 33.84 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 105.154 -2.165 . . . . 0.0 105.154 175.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.472 HG22 ' HB2' ' A' ' 29' ' ' TRP . 41.5 t -138.93 149.93 23.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 122.865 0.466 . . . . 0.0 110.61 -175.357 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -103.28 145.5 29.86 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.108 0.963 . . . . 0.0 110.325 175.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -136.5 149.9 48.4 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.131 1.373 . . . . 0.0 110.728 -176.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 CA--C 1.532 0.267 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 175.768 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.9 m . . . . . 0 N--CA 1.445 -0.696 0 N-CA-C 103.06 -2.941 . . . . 0.0 103.06 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -64.4 162.76 14.45 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -175.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 67.3 mtt180 -136.16 154.2 51.04 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 122.773 1.273 . . . . 0.0 110.732 -176.658 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 47.8 t -145.75 160.0 42.37 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 177.166 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -144.27 168.11 20.85 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 104.824 -2.287 . . . . 0.0 104.824 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -121.55 139.77 53.08 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 105.744 -1.947 . . . . 0.0 105.744 176.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -123.94 114.03 19.26 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 104.817 -2.29 . . . . 0.0 104.817 -176.34 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -89.09 113.29 24.42 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 102.892 -3.003 . . . . 0.0 102.892 175.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -88.59 140.35 15.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -125.96 123.18 37.95 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 102.232 -3.247 . . . . 0.0 102.232 175.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 48.2 t-105 -101.6 123.85 46.28 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 25.4 mt -142.2 78.39 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.09 149.96 11.0 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 108.792 -1.723 . . . . 0.0 108.792 175.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -68.19 -10.72 56.46 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.43 2.115 . . . . 0.0 113.001 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -83.6 -36.32 24.01 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 117.256 -1.354 . . . . 0.0 113.191 -175.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -53.21 133.92 15.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 CA-C-N 120.354 1.434 . . . . 0.0 110.049 175.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 31.4 t -58.72 156.48 10.96 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 123.209 1.481 . . . . 0.0 113.032 -175.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.64 -13.8 13.07 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 113.175 -1.83 . . . . 0.0 111.617 175.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.7 tp -72.01 -61.28 1.85 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 126.098 1.759 . . . . 0.0 110.621 175.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -68.55 -34.25 75.52 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.379 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.8 ttm180 -60.37 -42.66 96.27 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 175.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.27 -36.34 83.8 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-O 118.107 -0.949 . . . . 0.0 111.617 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -55.84 -38.38 69.99 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.945 1.248 . . . . 0.0 110.602 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 74.2 m -54.31 -34.52 61.16 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 119.739 1.154 . . . . 0.0 110.467 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.75 -25.73 70.65 Favored Glycine 0 CA--C 1.527 0.806 0 O-C-N 121.009 -1.057 . . . . 0.0 113.761 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.7 m -99.12 -13.41 19.81 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.589 1.956 . . . . 0.0 110.88 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -103.41 -24.11 13.5 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -174.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -59.73 -39.96 86.44 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 120.986 1.721 . . . . 0.0 111.149 -178.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.9 t -62.56 -31.22 71.98 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 118.611 -0.709 . . . . 0.0 110.732 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.606 HD11 ' HB ' ' A' ' 6' ' ' THR . 15.4 mt -62.81 -63.2 1.28 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 119.416 1.007 . . . . 0.0 109.573 -176.463 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.07 -30.36 47.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 117.188 -1.387 . . . . 0.0 109.455 175.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -61.91 -37.27 84.0 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 121.288 1.858 . . . . 0.0 110.288 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -60.79 -24.64 65.96 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 120.201 1.364 . . . . 0.0 111.117 179.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.654 HG11 ' HB3' ' A' ' 13' ' ' CYS . 43.7 t -86.82 -53.03 11.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 79.2 t -74.95 26.11 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 130.393 3.477 . . . . 0.0 111.427 -177.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -55.32 -26.13 38.74 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 119.618 -1.926 . . . . 0.0 112.492 -176.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -95.55 90.55 5.78 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 175.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -157.96 176.74 12.15 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.948 1.299 . . . . 0.0 108.041 179.622 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -106.31 -66.5 1.0 Allowed 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.829 -0.544 . . . . 0.0 112.013 177.594 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 14.0 mtpt -146.06 168.9 19.81 Favored 'General case' 0 CA--C 1.504 -0.826 0 C-N-CA 126.812 2.045 . . . . 0.0 110.017 176.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.33 179.72 4.19 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.82 -1.082 . . . . 0.0 109.553 175.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.25 140.63 23.25 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 104.256 -2.498 . . . . 0.0 104.256 -176.179 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.8 t -114.27 123.72 70.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -125.99 138.39 54.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 106.131 -1.803 . . . . 0.0 106.131 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.0 p -131.51 1.79 4.11 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -175.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -137.12 134.2 36.14 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.816 0.734 . . . . 0.0 109.455 177.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 17.3 ttp-105 -69.15 -28.83 66.78 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 118.195 -0.907 . . . . 0.0 112.723 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -70.42 -45.38 66.01 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 120.853 1.661 . . . . 0.0 106.623 175.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -58.37 -43.84 88.59 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 117.907 -1.044 . . . . 0.0 109.351 -176.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -44.04 -23.74 0.11 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 129.568 3.147 . . . . 0.0 115.081 -177.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -50.44 154.91 1.16 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 122.502 1.144 . . . . 0.0 114.064 175.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -61.08 -15.66 35.17 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 115.119 -0.946 . . . . 0.0 113.18 175.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -51.43 -64.95 0.65 Allowed 'General case' 0 C--O 1.242 0.689 0 CA-C-N 119.11 0.868 . . . . 0.0 111.022 176.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.92 -26.59 54.26 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 114.984 -2.686 . . . . 0.0 109.389 -175.296 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.7 -41.23 91.9 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 C-N-CA 123.7 0.8 . . . . 0.0 108.885 -176.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -62.1 -53.0 61.64 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 120.028 1.285 . . . . 0.0 109.929 179.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 44.0 t -65.08 -34.67 78.96 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 119.222 -0.418 . . . . 0.0 110.538 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -72.56 -44.38 62.16 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 123.902 0.881 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 65.0 mt -61.79 -31.05 71.23 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 118.342 -0.837 . . . . 0.0 108.853 175.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -69.43 -52.76 23.76 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.368 1.067 . . . . 0.0 109.298 174.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -51.34 -56.85 10.88 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.328 1.051 . . . . 0.0 109.531 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.691 0 C-N-CA 126.528 1.931 . . . . 0.0 113.794 177.816 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.517 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.4 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.4 m -119.05 170.89 8.66 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.63 1.972 . . . . 0.0 105.754 -177.355 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.0 tttt -139.04 176.28 8.83 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.612 -1.305 . . . . 0.0 111.247 -176.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.82 152.21 24.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 124.115 0.966 . . . . 0.0 108.961 175.577 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -100.34 78.6 2.05 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 104.678 -2.341 . . . . 0.0 104.678 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -61.89 -27.78 69.04 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.098 -0.953 . . . . 0.0 112.506 -175.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.22 -48.36 70.85 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 119.822 1.192 . . . . 0.0 110.255 177.094 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.16 -52.87 20.12 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.729 0.412 . . . . 0.0 110.121 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.9 m -62.31 -30.56 71.24 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.102 -0.951 . . . . 0.0 111.379 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.2 ttt180 -62.18 -35.19 78.1 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 115.946 -1.978 . . . . 0.0 109.112 175.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.87 -59.78 4.19 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 121.033 1.742 . . . . 0.0 109.906 -177.337 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.32 95.35 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.968 -0.458 . . . . 0.0 111.919 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -54.76 -46.31 74.34 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 175.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -58.07 -47.75 82.23 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.213 1.405 . . . . 0.0 110.102 -175.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -57.19 -62.92 1.42 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.014 0.926 . . . . 0.0 109.855 175.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.1 t -60.2 -24.95 32.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 O-C-N 121.559 -0.713 . . . . 0.0 112.244 -176.198 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -75.73 -31.33 59.57 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.45 1.1 . . . . 0.0 111.725 175.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.24 125.29 33.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 127.687 2.395 . . . . 0.0 112.665 -175.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.66 -19.47 58.4 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.232 1.013 . . . . 0.0 112.843 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.99 -10.09 86.42 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.015 1.293 . . . . 0.0 113.464 176.432 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.6 t -79.61 127.52 32.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 119.326 1.563 . . . . 0.0 109.053 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.36 -35.73 73.73 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 175.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.6 t -64.38 133.2 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 127.633 2.373 . . . . 0.0 108.571 175.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 pp -115.94 -23.66 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 126.109 1.763 . . . . 0.0 111.46 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 51.0 p-90 -123.57 147.87 46.88 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.838 0.855 . . . . 0.0 109.74 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.9 t -137.07 162.92 33.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 129.513 3.125 . . . . 0.0 107.835 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.444 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 41.3 p -125.18 159.15 32.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.61 1.164 . . . . 0.0 109.075 175.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -132.44 123.8 27.36 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -102.86 176.23 5.22 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 175.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.419 ' CE2' HD12 ' A' ' 39' ' ' ILE . 27.1 m-85 -128.53 129.41 45.98 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 -175.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -129.08 131.02 47.23 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.919 1.688 . . . . 0.0 106.487 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 45.53 -114.53 1.28 Allowed Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.114 -1.195 . . . . 0.0 110.114 -176.279 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 p -120.74 45.61 2.2 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.968 1.307 . . . . 0.0 111.208 176.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.5 t -142.93 169.42 17.6 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.369 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.419 HD12 ' CE2' ' A' ' 34' ' ' TYR . 7.7 mm -98.61 139.4 20.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 175.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.3 m -128.53 146.18 58.94 Favored Pre-proline 0 N--CA 1.469 0.491 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.289 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.14 150.22 59.44 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 121.988 1.792 . . . . 0.0 109.288 175.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -124.3 -157.57 9.8 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 125.784 1.659 . . . . 0.0 110.629 177.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -51.56 161.5 0.49 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 125.906 1.682 . . . . 0.0 112.277 176.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.4 164.95 33.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.57 1.148 . . . . 0.0 109.124 176.312 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.73 176.96 44.05 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 123.578 0.609 . . . . 0.0 111.751 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -107.79 -15.61 14.52 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.355 1.462 . . . . 0.0 113.533 -176.407 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -123.63 142.63 50.86 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 -176.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -83.36 -8.91 59.33 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.799 1.036 . . . . 0.0 113.799 -174.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -54.1 -36.85 63.64 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.846 1.203 . . . . 0.0 110.137 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -62.68 -28.81 70.19 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.044 1.337 . . . . 0.0 112.158 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' PHE . . . . . 0.424 ' CD1' HD11 ' A' ' 123' ' ' LEU . 0.7 OUTLIER -63.52 -52.45 61.16 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -178.966 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.52 -36.78 76.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -176.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -60.83 -31.88 71.29 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.67 0.788 . . . . 0.0 112.102 175.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -85.67 -24.04 27.19 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.008 0.923 . . . . 0.0 113.455 -175.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 96.6 m -59.85 120.75 10.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.602 1.092 . . . . 0.0 112.539 -175.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 2.4 p -104.92 -173.53 2.32 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 127.181 2.192 . . . . 0.0 113.898 -178.219 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -73.67 -75.93 0.14 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 129.619 3.168 . . . . 0.0 117.964 -175.081 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -102.35 -24.76 13.83 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.051 1.74 . . . . 0.0 115.353 -174.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.7 m -63.94 158.78 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 CA-C-O 122.816 1.293 . . . . 0.0 112.37 -175.494 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.3 ptt-85 -108.41 130.65 55.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 102.894 -3.002 . . . . 0.0 102.894 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 31.8 tp -140.7 156.09 46.3 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -175.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -131.38 148.72 52.69 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.362 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.444 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.94 129.16 16.69 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.344 0.658 . . . . 0.0 111.629 -179.075 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.424 ' CE1' HG13 ' A' ' 108' ' ' VAL . 33.0 t80 -96.44 123.64 40.16 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 175.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.3 t -134.39 141.4 43.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 123.426 0.69 . . . . 0.0 109.304 -175.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -85.06 137.84 32.8 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 175.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -131.49 168.22 18.01 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 127.648 2.379 . . . . 0.0 106.622 -176.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.3 m . . . . . 0 C--N 1.325 -0.496 0 O-C-N 121.069 -1.02 . . . . 0.0 108.739 -177.295 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.4 m . . . . . 0 N--CA 1.45 -0.441 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -46.16 152.84 0.37 Allowed 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.35 1.86 . . . . 0.0 113.254 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 -121.21 148.32 44.42 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 123.638 0.775 . . . . 0.0 109.881 -176.236 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.6 t -146.89 137.82 23.92 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.658 1.583 . . . . 0.0 109.168 175.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.442 ' HA ' ' HE2' ' A' ' 78' ' ' LYS . 4.4 mmpt? -145.99 176.04 10.0 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 127.998 2.519 . . . . 0.0 108.115 175.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -141.56 146.36 36.23 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 176.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -125.47 122.44 36.65 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 176.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -97.65 113.33 25.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 100.421 -3.918 . . . . 0.0 100.421 174.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.9 mp -97.36 144.71 10.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -123.62 123.36 40.4 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 103.258 -2.867 . . . . 0.0 103.258 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -96.04 123.48 39.66 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 103.716 -2.698 . . . . 0.0 103.716 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.652 HD11 HG21 ' A' ' 97' ' ' THR . 12.3 mt -144.91 97.77 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 104.134 -2.543 . . . . 0.0 104.134 178.416 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.62 166.02 4.75 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-O 121.717 0.621 . . . . 0.0 113.07 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -75.78 -19.23 59.15 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.213 -1.757 . . . . 0.0 110.009 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -82.72 -20.71 35.49 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 120.812 -1.18 . . . . 0.0 113.486 -175.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . 0.257 0.8 OUTLIER -66.33 140.16 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 119.852 1.205 . . . . 0.0 113.373 -177.777 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 47.7 t -70.88 144.59 50.62 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 126.136 1.774 . . . . 0.0 109.89 179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -60.51 -21.16 57.11 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-O 119.179 -0.79 . . . . 0.0 113.205 179.46 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 tt -65.06 -32.58 74.36 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.872 1.336 . . . . 0.0 110.062 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -80.09 -44.07 20.66 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 175.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.8 ttp85 -58.62 -25.03 62.24 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.514 1.052 . . . . 0.0 111.298 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.34 70.57 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 120.849 -1.157 . . . . 0.0 111.861 175.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -64.99 -39.12 92.99 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-O 118.032 -0.985 . . . . 0.0 108.764 175.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.652 HG21 HD11 ' A' ' 85' ' ' ILE . 2.5 m -54.26 -34.81 61.64 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.383 0.673 . . . . 0.0 110.137 179.132 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.67 -12.37 56.37 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 125.135 1.35 . . . . 0.0 114.805 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.6 m -125.45 2.7 7.68 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.784 2.034 . . . . 0.0 110.603 175.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -103.62 -42.93 5.51 Favored 'General case' 0 C--O 1.226 -0.157 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -177.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.564 ' HE2' ' HG3' ' A' ' 114' ' ' GLU . 9.3 mtpm? -59.59 -28.81 67.49 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.52 -1.363 . . . . 0.0 112.44 -176.241 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.5 t -68.14 -47.01 69.23 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.458 1.503 . . . . 0.0 108.855 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.4 HD11 ' HB ' ' A' ' 6' ' ' THR . 14.5 mt -59.44 -58.04 10.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.855 1.662 . . . . 0.0 109.987 -176.127 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.4 p -62.21 -30.93 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-O 117.27 -1.347 . . . . 0.0 109.667 176.028 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.82 -31.16 72.24 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 121.178 1.808 . . . . 0.0 110.893 176.036 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -63.57 -25.73 68.37 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 120.154 1.343 . . . . 0.0 111.099 176.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 57.5 t -86.19 -56.97 4.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 175.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.424 HG13 ' CE1' ' A' ' 64' ' ' PHE . 86.3 t -73.01 26.65 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 131.106 3.762 . . . . 0.0 112.127 -175.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -52.76 -21.63 4.34 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 119.679 -1.888 . . . . 0.0 113.717 -176.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -99.02 84.39 3.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 174.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -147.42 170.11 18.07 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 175.471 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 -66.32 0.91 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -176.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -152.85 169.26 23.25 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 127.12 2.168 . . . . 0.0 108.159 175.538 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.564 ' HG3' ' HE2' ' A' ' 101' ' ' LYS . 0.7 OUTLIER -107.19 167.77 9.68 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 175.193 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -137.6 152.17 49.11 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 -175.052 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.8 t -121.24 124.87 72.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 175.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mp -124.94 141.47 44.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 176.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.2 p -130.89 6.46 4.65 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.304 1.442 . . . . 0.0 112.827 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -139.81 128.87 23.65 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.573 0.624 . . . . 0.0 111.305 175.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 -64.99 -32.87 74.8 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 124.778 1.231 . . . . 0.0 113.966 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.696 ' HE3' ' H ' ' A' ' 121' ' ' LYS . 0.3 OUTLIER -76.21 -41.04 50.69 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 120.98 1.718 . . . . 0.0 109.667 176.622 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.9 -37.42 86.88 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.022 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.424 HD11 ' CD1' ' A' ' 51' ' ' PHE . 2.4 tm? -45.0 -23.65 0.16 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 129.382 3.073 . . . . 0.0 115.076 -176.65 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -44.41 140.19 2.4 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.74 1.216 . . . . 0.0 110.856 175.559 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.29 -14.56 2.94 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -54.01 -55.6 25.78 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 124.345 1.058 . . . . 0.0 111.97 177.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.42 -25.7 35.96 Favored 'General case' 0 C--N 1.352 0.682 0 C-N-CA 116.614 -2.035 . . . . 0.0 108.713 -177.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 64.8 mt -60.74 -49.04 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -55.61 -51.33 67.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.266 0.626 . . . . 0.0 109.878 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.0 t -63.88 -38.55 91.5 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.454 0.702 . . . . 0.0 111.007 -176.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -67.91 -40.29 83.46 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.838 1.255 . . . . 0.0 109.688 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 96.7 mt -72.82 -24.69 60.94 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.07 -1.018 . . . . 0.0 110.339 175.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.6 mtpt -73.78 -47.29 39.97 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 125.185 1.394 . . . . 0.0 108.403 175.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -54.01 -65.41 0.57 Allowed 'General case' 0 C--O 1.234 0.251 0 C-N-CA 126.247 1.819 . . . . 0.0 108.508 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 176.299 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.326 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 m -71.01 149.29 46.77 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.163 2.185 . . . . 0.0 106.283 175.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.6 mtmt -132.02 179.97 5.77 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.091 0.956 . . . . 0.0 109.413 -176.306 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.581 HG22 HG12 ' A' ' 39' ' ' ILE . 0.2 OUTLIER -121.25 153.67 24.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 C-N-CA 124.129 0.971 . . . . 0.0 110.189 176.188 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -91.57 80.57 5.39 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 103.682 -2.71 . . . . 0.0 103.682 175.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -62.88 -27.4 69.33 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 117.383 -1.294 . . . . 0.0 111.94 -175.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -72.33 -53.9 11.05 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 119.64 1.109 . . . . 0.0 109.236 178.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.39 -43.82 96.47 Favored 'General case' 0 CA--C 1.527 0.069 0 CA-C-N 118.342 0.519 . . . . 0.0 111.064 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 81.2 m -70.27 -30.6 67.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.373 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -61.15 -34.54 75.18 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-O 116.834 -1.555 . . . . 0.0 109.853 176.02 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.28 -57.73 10.08 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 119.753 1.161 . . . . 0.0 110.157 -177.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.49 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -66.86 -41.94 86.5 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.208 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -52.7 -40.13 62.67 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 123.312 0.645 . . . . 0.0 111.104 175.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -63.21 -45.06 93.46 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.81 0.844 . . . . 0.0 110.574 -176.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.53 -50.68 72.57 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 123.853 0.861 . . . . 0.0 110.605 175.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.6 t -65.99 -30.52 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-O 119.49 -0.29 . . . . 0.0 111.218 -178.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.455 ' CZ ' ' HA ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -66.5 -48.84 68.54 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 118.077 -0.964 . . . . 0.0 108.725 175.764 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.455 ' HA ' ' CZ ' ' A' ' 21' ' ' ARG . 7.5 t70 -62.16 140.53 58.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 123.981 0.801 . . . . 0.0 112.289 -175.472 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -78.75 -19.51 52.13 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 117.566 -1.207 . . . . 0.0 113.691 -175.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -105.99 -1.66 39.14 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 118.846 -0.975 . . . . 0.0 114.096 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 t -71.74 147.95 46.85 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.365 1.582 . . . . 0.0 109.133 176.03 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.88 -33.11 59.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.328 176.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.7 t -74.79 123.48 30.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 175.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.2 pp -114.64 -23.89 4.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 C-N-CA 124.289 1.035 . . . . 0.0 110.874 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.405 ' CZ2' ' HA3' ' A' ' 45' ' ' GLY . 34.3 p-90 -124.64 144.98 49.89 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.632 0.773 . . . . 0.0 109.194 178.517 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.49 HG21 ' HB1' ' A' ' 16' ' ' ALA . 5.8 t -135.68 161.93 37.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 127.113 2.165 . . . . 0.0 107.594 176.521 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 72.3 p -125.55 157.83 36.1 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 175.385 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -127.5 123.71 36.57 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 176.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -94.46 176.01 6.46 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.44 ' CE2' HD12 ' A' ' 39' ' ' ILE . 21.7 m-85 -119.65 137.5 53.84 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 175.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -137.47 123.97 20.86 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 50.67 -110.88 1.03 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.5 p -110.71 27.39 9.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.648 1.579 . . . . 0.0 112.56 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -148.07 172.6 14.01 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 119.25 0.932 . . . . 0.0 113.143 176.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.581 HG12 HG22 ' A' ' 8' ' ' ILE . 7.8 mm -99.0 134.19 38.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 105.063 -2.199 . . . . 0.0 105.063 175.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.1 m -127.66 159.62 65.08 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 123.186 0.594 . . . . 0.0 111.262 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.99 144.19 57.27 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 121.809 1.673 . . . . 0.0 110.428 175.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -113.83 -155.05 11.4 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 125.827 1.679 . . . . 0.0 110.078 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -63.56 159.61 18.38 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.688 1.195 . . . . 0.0 110.808 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -143.96 165.97 26.27 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 125.523 1.529 . . . . 0.0 109.043 176.125 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.405 ' HA3' ' CZ2' ' A' ' 29' ' ' TRP . . . -178.51 -175.65 45.78 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 124.016 0.817 . . . . 0.0 111.818 -176.604 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -118.39 -22.7 7.51 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.215 1.406 . . . . 0.0 112.465 -176.222 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -115.07 130.5 56.95 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 -176.183 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -83.04 -7.57 59.64 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.042 0.837 . . . . 0.0 111.456 -175.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -54.23 -37.16 64.3 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.283 -1.511 . . . . 0.0 111.69 175.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -70.11 -26.86 64.16 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.829 1.252 . . . . 0.0 112.444 177.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -62.49 -46.61 87.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.472 1.509 . . . . 0.0 109.477 -177.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 mp -61.12 -42.07 91.8 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -177.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -65.57 -24.01 66.98 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.369 0.531 . . . . 0.0 112.425 176.081 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -80.93 -23.9 38.56 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.842 1.201 . . . . 0.0 112.251 176.133 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 99.1 m -60.16 123.56 17.54 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 104.284 -2.488 . . . . 0.0 104.284 175.499 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.509 ' OG1' HG22 ' A' ' 59' ' ' VAL . 72.7 p -82.84 174.04 11.3 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -174.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -60.76 -76.55 0.05 OUTLIER 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.433 2.293 . . . . 0.0 109.424 176.093 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -106.4 -36.53 6.79 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -175.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.509 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -60.62 165.7 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.293 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -174.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 28.1 ptt-85 -103.77 151.62 22.83 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 175.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.8 tp -148.65 161.53 41.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -127.16 151.07 49.16 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.481 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.58 157.87 43.92 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.088 0.555 . . . . 0.0 111.842 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.419 ' CE1' HG13 ' A' ' 108' ' ' VAL . 34.0 t80 -131.37 123.78 28.95 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 -178.148 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 39.6 t -137.67 141.63 38.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -175.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.2 ttp-105 -83.99 138.31 33.18 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 175.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -136.13 153.58 51.25 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 125.474 1.509 . . . . 0.0 107.837 -177.523 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 92.3 m . . . . . 0 N--CA 1.446 -0.631 0 O-C-N 121.124 -0.985 . . . . 0.0 109.122 -179.152 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 66.5 m . . . . . 0 N--CA 1.445 -0.691 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -61.32 155.4 21.36 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.583 0.706 . . . . 0.0 109.847 -177.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 46.6 mtp180 -133.55 176.32 8.65 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 126.044 1.738 . . . . 0.0 109.351 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 8.5 t -142.35 160.17 40.79 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 124.473 1.109 . . . . 0.0 110.109 -176.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -145.06 171.57 14.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 130.852 3.661 . . . . 0.0 106.608 176.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -143.18 143.44 31.78 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 175.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.57 118.3 31.77 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 178.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -87.88 113.7 23.79 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 101.988 -3.338 . . . . 0.0 101.988 175.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.6 mp -101.31 143.14 14.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 -176.036 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -125.69 123.58 39.23 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 175.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -93.37 123.72 36.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 104.868 -2.271 . . . . 0.0 104.868 175.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.8 mt -143.12 92.29 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -58.93 156.11 24.84 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 108.308 -1.917 . . . . 0.0 108.308 175.38 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -74.33 -4.43 36.25 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 119.997 -1.884 . . . . 0.0 111.084 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -83.83 -36.4 23.52 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 121.254 -0.904 . . . . 0.0 110.771 -175.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.5 p -64.45 128.99 27.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 175.519 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.4 t -60.5 154.33 21.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.527 1.156 . . . . 0.0 111.745 -175.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -53.67 -30.84 44.19 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 125.59 1.567 . . . . 0.0 113.179 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.6 tt -62.97 -41.44 99.55 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.489 1.116 . . . . 0.0 111.12 178.442 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -76.92 -41.24 44.29 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.45 -35.0 62.53 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.64 1.109 . . . . 0.0 109.806 175.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.37 -30.25 64.72 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 119.877 1.217 . . . . 0.0 113.412 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 23.7 mmtp -57.88 -31.91 67.17 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 119.384 0.993 . . . . 0.0 110.833 175.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.5 m -56.65 -33.98 66.87 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.493 1.042 . . . . 0.0 109.933 -178.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.23 -14.97 67.14 Favored Glycine 0 CA--C 1.535 1.324 0 CA-C-O 119.143 -0.81 . . . . 0.0 113.834 177.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.8 m -112.32 -4.62 14.27 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.684 2.394 . . . . 0.0 110.245 176.448 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -104.48 -35.36 7.92 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 124.257 1.023 . . . . 0.0 111.532 -175.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -59.6 -34.71 73.09 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.108 -0.995 . . . . 0.0 111.058 -177.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 7.0 t -66.98 -33.87 76.52 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.804 1.241 . . . . 0.0 110.369 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.538 ' O ' HG21 ' A' ' 8' ' ' ILE . 13.2 mt -70.91 -63.29 1.13 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.687 1.195 . . . . 0.0 108.88 -176.629 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.267 0.9 OUTLIER -59.46 -25.2 30.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-O 117.909 -1.043 . . . . 0.0 109.537 175.562 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -61.8 -41.97 98.42 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 120.909 1.686 . . . . 0.0 108.818 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -51.03 -31.03 17.08 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 120.704 1.593 . . . . 0.0 111.75 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 96.4 t -85.32 -63.57 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 124.685 1.194 . . . . 0.0 108.096 175.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.419 HG13 ' CE1' ' A' ' 64' ' ' PHE . 45.0 t -71.14 26.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 C-N-CA 130.566 3.546 . . . . 0.0 112.824 -175.679 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -57.63 -26.96 62.35 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.776 -1.828 . . . . 0.0 113.525 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -91.56 79.87 5.45 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 175.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -144.0 165.05 28.84 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 123.225 0.61 . . . . 0.0 109.569 177.725 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.63 -66.63 0.89 Allowed 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.36 175.72 12.8 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 126.451 1.901 . . . . 0.0 109.176 -175.785 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -115.41 164.51 14.17 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 123.429 0.456 . . . . 0.0 110.67 175.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -139.95 142.22 36.39 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 102.659 -3.089 . . . . 0.0 102.659 -175.708 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.34 128.5 73.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 176.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -128.25 145.14 35.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 125.985 1.714 . . . . 0.0 106.796 -176.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 42.0 p -131.31 -7.07 3.79 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.558 1.143 . . . . 0.0 113.464 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -116.73 130.08 56.51 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 15.2 ttp-105 -72.88 -28.54 62.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 118.61 -0.71 . . . . 0.0 111.964 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -69.89 -45.79 66.88 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 119.503 1.047 . . . . 0.0 109.017 175.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -53.55 -47.36 70.09 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 124.434 1.094 . . . . 0.0 110.16 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -43.91 -24.11 0.12 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 128.483 2.713 . . . . 0.0 116.793 -175.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -44.6 143.38 1.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 124.097 0.959 . . . . 0.0 110.636 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -60.33 -21.19 61.75 Favored 'General case' 0 C--N 1.341 0.213 0 O-C-N 121.587 -0.695 . . . . 0.0 111.024 -178.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -46.1 -59.17 3.03 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 125.34 1.456 . . . . 0.0 112.308 -175.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -81.15 -26.33 36.17 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 115.933 -2.307 . . . . 0.0 109.274 -176.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 36.2 mt -57.83 -44.07 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -60.34 -50.22 74.49 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 123.54 0.736 . . . . 0.0 111.64 -175.711 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -75.7 -30.68 59.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.554 0.616 . . . . 0.0 111.368 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.09 -46.46 81.02 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.044 -1.035 . . . . 0.0 108.922 176.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.64 -26.16 67.69 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.084 0.954 . . . . 0.0 111.648 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -63.59 -60.54 3.2 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 175.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? -53.82 -57.36 11.19 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 123.652 0.595 . . . . 0.0 110.474 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.369 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -176.281 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.379 0 N-CA-C 110.361 -1.095 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.0 pt -131.19 98.02 3.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 125.669 1.588 . . . . 0.0 107.009 178.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 69.6 mtp85 -103.57 148.67 25.71 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.5 tpt -71.33 82.11 0.76 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 175.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -144.19 44.52 1.44 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 127.243 2.217 . . . . 0.0 108.105 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.6 m -83.72 172.64 12.05 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.417 2.287 . . . . 0.0 107.538 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.503 ' HG3' ' H ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -150.14 -177.12 5.74 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 119.908 -1.745 . . . . 0.0 111.298 -175.407 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.503 ' H ' ' HG3' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -142.8 146.75 21.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 C-N-CA 127.312 2.245 . . . . 0.0 105.384 175.073 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -92.07 83.42 5.13 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 102.167 -3.271 . . . . 0.0 102.167 174.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.9 pttt -58.22 -33.48 69.37 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-O 117.167 -1.397 . . . . 0.0 113.064 -175.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -78.03 -44.26 27.0 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 120.354 1.434 . . . . 0.0 110.353 -176.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.8 -40.06 94.61 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 119.249 0.932 . . . . 0.0 110.537 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 62.0 m -72.45 -34.8 68.01 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.45 -0.781 . . . . 0.0 110.625 178.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.98 -35.97 74.1 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.904 175.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.14 -54.15 49.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 119.071 0.851 . . . . 0.0 109.997 -176.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.41 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -67.46 -40.96 85.35 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.665 0.666 . . . . 0.0 111.297 177.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -50.62 -47.89 58.18 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.264 0.626 . . . . 0.0 110.781 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -54.66 -41.04 69.67 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.899 1.28 . . . . 0.0 111.636 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 mp -68.81 -61.52 1.77 Allowed 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 124.183 0.993 . . . . 0.0 110.697 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.3 t -55.83 -31.55 30.19 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.783 -175.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -29.98 67.83 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.617 1.099 . . . . 0.0 111.916 175.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -85.6 125.84 33.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.665 1.121 . . . . 0.0 112.546 -175.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -61.79 -15.8 44.5 Favored 'General case' 0 C--N 1.344 0.346 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 175.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.91 -9.37 57.35 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 125.286 1.422 . . . . 0.0 112.61 176.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.0 t -66.8 127.08 31.11 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 120.338 2.069 . . . . 0.0 108.162 175.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.8 -32.73 73.97 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.7 t -72.57 123.69 27.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 104.424 -2.436 . . . . 0.0 104.424 175.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -113.29 -25.27 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 C-N-CA 123.33 0.652 . . . . 0.0 109.974 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 24.7 p-90 -126.03 145.87 50.13 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 121.838 0.828 . . . . 0.0 109.418 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.41 HG21 ' HB1' ' A' ' 16' ' ' ALA . 6.0 t -138.33 159.97 31.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 127.664 2.386 . . . . 0.0 106.024 175.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 35.4 p -120.2 153.54 36.12 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 175.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -122.3 123.7 42.03 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 104.805 -2.295 . . . . 0.0 104.805 175.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 41.6 mmtt -102.37 176.46 5.17 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.538 1.935 . . . . 0.0 105.999 -177.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -126.44 152.32 46.56 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 175.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -146.63 163.92 34.3 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 125.888 1.675 . . . . 0.0 107.564 175.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 24.36 -88.18 0.01 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 128.51 2.957 . . . . 0.0 115.311 178.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 27.0 p -136.12 26.74 3.23 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.726 1.211 . . . . 0.0 110.154 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -142.53 157.24 44.94 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -175.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 1.8 mp -84.99 142.95 12.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 N-CA-C 103.935 -2.617 . . . . 0.0 103.935 175.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.46 161.72 57.34 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 125.398 1.479 . . . . 0.0 110.206 -177.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -71.41 152.89 61.02 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 121.572 1.515 . . . . 0.0 110.169 175.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -120.86 -152.37 8.82 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 126.103 1.811 . . . . 0.0 109.767 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.19 163.11 10.74 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.243 1.417 . . . . 0.0 110.458 175.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -141.77 161.19 38.56 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 126.455 1.902 . . . . 0.0 109.429 177.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -176.09 -179.66 46.68 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-O 121.981 0.767 . . . . 0.0 112.623 177.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.6 -13.93 9.13 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.433 1.493 . . . . 0.0 112.534 -176.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -120.73 130.98 54.28 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.524 1.13 . . . . 0.0 107.958 -175.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -83.48 -13.08 55.45 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -175.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -57.81 -43.48 85.75 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 119.776 -1.827 . . . . 0.0 109.635 175.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -68.85 -21.93 64.25 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 119.048 -0.501 . . . . 0.0 111.585 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -61.45 -43.86 98.12 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 120.373 1.442 . . . . 0.0 107.9 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.3 mm -56.71 -47.27 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 123.475 0.71 . . . . 0.0 109.268 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -61.2 -40.25 93.27 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.527 0.731 . . . . 0.0 111.315 -177.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -69.87 -23.33 63.24 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 125.528 1.531 . . . . 0.0 113.894 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.5 m -65.23 113.55 4.08 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 176.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.301 2.1 p -91.07 -174.43 3.98 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.039 2.135 . . . . 0.0 111.746 -176.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -81.26 -75.95 0.26 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -175.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -95.19 -25.41 16.4 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 -175.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 8.4 m -63.72 149.2 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 O-C-N 120.706 -1.246 . . . . 0.0 108.569 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -103.28 129.44 50.28 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 103.174 -2.899 . . . . 0.0 103.174 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.3 tp -130.0 160.59 33.19 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -130.82 153.34 49.19 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 175.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.473 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -138.8 158.73 43.68 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.466 0.65 . . . . 0.0 110.338 175.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -129.64 123.48 31.33 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 103.88 -2.637 . . . . 0.0 103.88 177.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.3 t -134.53 135.34 53.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -175.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 59.5 ttp85 -80.64 123.63 28.31 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 104.883 -2.266 . . . . 0.0 104.883 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -135.26 123.83 23.57 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.278 1.037 . . . . 0.0 110.248 -175.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 26.8 m -86.41 114.09 22.9 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 124.364 1.066 . . . . 0.0 111.589 -175.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.3 m -156.49 166.63 32.86 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 175.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 101.91 113.79 3.75 Favored Glycine 0 CA--C 1.501 -0.797 0 N-CA-C 103.765 -3.734 . . . . 0.0 103.765 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -99.45 113.63 26.1 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 111.935 -2.133 . . . . 0.0 108.374 -174.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.96 178.28 8.65 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 125.41 1.484 . . . . 0.0 108.008 175.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.6 mmt -71.63 9.0 0.94 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.789 0.836 . . . . 0.0 110.621 175.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.5 m -146.34 151.51 37.61 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 118.928 -2.358 . . . . 0.0 107.387 175.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -63.21 157.81 21.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.327 0.585 . . . . 0.0 110.706 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.1 mtt-85 -141.86 155.54 45.54 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 105.05 -2.204 . . . . 0.0 105.05 175.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 t -144.25 160.85 40.29 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.4 mtpt -145.81 176.47 9.64 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 126.395 1.878 . . . . 0.0 108.795 -175.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -135.68 140.4 44.44 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -121.19 117.82 28.09 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.965 1.706 . . . . 0.0 107.222 -176.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -87.97 113.58 23.76 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 105.091 -2.188 . . . . 0.0 105.091 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.7 mt -104.4 143.2 16.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 -176.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -123.94 123.71 41.01 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 175.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -96.49 123.75 40.26 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 125.766 1.626 . . . . 0.0 106.731 175.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.4 mt -143.4 97.38 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 176.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -60.64 169.73 8.26 Favored Glycine 0 CA--C 1.537 1.431 0 CA-C-N 119.816 1.189 . . . . 0.0 112.101 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -76.96 -12.39 59.94 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 119.991 -1.888 . . . . 0.0 109.978 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -83.15 -29.69 28.45 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 120.207 -1.558 . . . . 0.0 112.511 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.7 125.35 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 CA-C-O 121.586 0.708 . . . . 0.0 111.831 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 18.9 t -64.85 150.27 47.97 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 124.529 1.131 . . . . 0.0 110.681 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.45 -28.01 58.94 Favored Glycine 0 CA--C 1.521 0.448 0 C-N-CA 125.339 1.447 . . . . 0.0 113.913 -178.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.6 tt -59.2 -37.35 77.24 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.116 1.458 . . . . 0.0 110.241 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -73.76 -43.82 57.91 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 121.266 -0.896 . . . . 0.0 109.073 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -57.27 -28.93 63.42 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.847 -0.597 . . . . 0.0 110.359 177.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.74 -44.38 97.01 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 119.599 1.091 . . . . 0.0 109.703 176.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.07 -54.98 40.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 118.014 -0.994 . . . . 0.0 108.331 175.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 59.7 m -50.58 -39.63 50.18 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.925 0.89 . . . . 0.0 110.112 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.04 -26.4 74.03 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 118.562 -1.132 . . . . 0.0 113.745 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.1 m -105.07 -0.41 26.72 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.627 1.571 . . . . 0.0 110.981 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -103.96 -24.16 13.27 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 124.809 1.244 . . . . 0.0 110.084 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -52.57 -37.96 58.99 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 119.883 1.22 . . . . 0.0 111.5 175.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.1 t -56.82 -41.68 78.25 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.067 0.849 . . . . 0.0 110.393 175.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 28.4 mt -64.18 -64.74 0.8 Allowed 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 125.871 1.668 . . . . 0.0 109.685 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -57.51 -30.76 37.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 117.852 -1.071 . . . . 0.0 110.257 175.638 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -65.42 -31.35 72.41 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 120.739 1.609 . . . . 0.0 110.468 176.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -63.52 -23.8 67.55 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 121.112 1.778 . . . . 0.0 111.966 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 81.1 t -85.55 -53.82 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 175.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 53.7 t -78.28 25.9 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 128.012 2.525 . . . . 0.0 111.993 -175.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -58.07 -25.65 61.53 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 120.031 -1.668 . . . . 0.0 109.864 175.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.01 67.8 4.8 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.298 1.839 . . . . 0.0 106.688 175.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.12 174.53 11.23 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 121.157 -0.964 . . . . 0.0 111.778 179.084 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -110.27 -47.63 3.27 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.761 0.825 . . . . 0.0 110.868 -176.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.2 mptt -158.7 174.68 14.67 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 128.414 2.686 . . . . 0.0 107.486 175.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -120.19 163.19 18.11 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.081 1.752 . . . . 0.0 109.661 176.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -140.54 156.64 46.25 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 103.744 -2.688 . . . . 0.0 103.744 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.8 t -132.58 127.97 57.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.5 mp -134.07 145.86 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 125.958 1.703 . . . . 0.0 109.21 -175.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 78.3 p -138.9 -5.9 1.48 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 126.664 1.985 . . . . 0.0 114.032 -175.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -141.54 153.94 45.17 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 119.227 0.921 . . . . 0.0 109.542 -176.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -37.94 89.22 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.954 -1.092 . . . . 0.0 111.523 -178.426 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 8.0 mttp -66.05 -31.14 71.85 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 124.745 1.218 . . . . 0.0 110.315 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -77.37 -23.39 50.81 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.448 1.899 . . . . 0.0 110.208 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -82.9 -23.13 33.69 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 127.025 2.13 . . . . 0.0 112.658 -178.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -57.9 123.47 15.92 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.183 0.901 . . . . 0.0 111.728 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.8 -23.98 55.09 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 115.639 1.718 . . . . 0.0 115.639 177.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -61.12 -55.61 30.49 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -174.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -74.58 -26.26 59.81 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 117.632 -1.627 . . . . 0.0 109.662 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 54.0 mt -56.86 -34.66 44.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 124.652 1.181 . . . . 0.0 109.144 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 38.9 mttt -55.79 -55.4 32.86 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 120.172 1.351 . . . . 0.0 110.063 175.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 5.2 t -67.98 -34.91 77.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.501 0.32 . . . . 0.0 110.507 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -63.63 -42.42 98.15 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.227 -0.921 . . . . 0.0 109.236 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 56.4 mt -69.95 -23.52 63.2 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.167 1.387 . . . . 0.0 111.45 175.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -74.89 -51.02 14.93 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 174.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -53.24 -56.73 14.16 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.025 1.33 . . . . 0.0 109.765 175.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.77 -14.27 62.41 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.892 0.877 . . . . 0.0 112.656 178.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -84.54 -67.79 1.42 Allowed Glycine 0 C--N 1.333 0.368 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 148.05 164.16 11.18 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 129.399 3.38 . . . . 0.0 107.747 -175.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -153.57 167.5 29.3 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.429 1.092 . . . . 0.0 109.121 176.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -154.25 153.54 31.9 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 128.845 2.858 . . . . 0.0 105.859 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -148.26 88.79 1.67 Allowed 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 105.239 -2.134 . . . . 0.0 105.239 175.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -154.04 143.95 21.87 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 127.324 2.25 . . . . 0.0 105.529 176.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.63 69.24 0.6 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.896 0.771 . . . . 0.0 112.322 -176.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -146.56 170.21 17.37 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.151 0.887 . . . . 0.0 109.344 175.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.5 m 86.24 23.66 0.07 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 129.826 3.25 . . . . 0.0 109.699 -175.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 C--O 1.247 0.963 0 C-N-CA 131.586 3.954 . . . . 0.0 102.726 175.474 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.649 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.1 tt -76.02 123.4 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -174.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 29.2 ttm105 -126.73 129.72 48.95 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 175.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 9.8 mtt -71.54 69.87 0.63 Allowed 'General case' 0 C--O 1.236 0.395 0 C-N-CA 126.038 1.735 . . . . 0.0 109.977 176.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.42 146.29 43.01 Favored 'General case' 0 C--O 1.238 0.48 0 O-C-N 121.684 -0.635 . . . . 0.0 109.626 177.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.828 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.5 m -66.99 165.59 15.31 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 175.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -123.93 -176.13 3.4 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.526 -1.359 . . . . 0.0 111.327 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -143.64 156.62 16.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 124.002 0.921 . . . . 0.0 110.45 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -100.79 85.74 2.95 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 102.587 -3.116 . . . . 0.0 102.587 174.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -65.46 -32.26 73.78 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 117.927 -1.035 . . . . 0.0 111.962 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -67.76 -50.49 56.85 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.847 1.203 . . . . 0.0 109.815 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.03 -45.9 76.06 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -177.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.7 m -72.31 -30.86 65.18 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 118.754 -0.641 . . . . 0.0 111.297 -177.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 51.1 ttm-85 -67.34 -31.99 72.62 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 116.952 -1.499 . . . . 0.0 108.84 175.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.09 -60.0 3.99 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 120.494 1.497 . . . . 0.0 109.744 -178.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.98 -38.86 89.61 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.171 0.442 . . . . 0.0 111.529 -177.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -56.5 -41.69 77.11 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 122.736 0.414 . . . . 0.0 110.219 176.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -62.03 -45.93 91.4 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 124.61 1.164 . . . . 0.0 110.27 -177.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.84 -59.8 4.86 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 175.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.543 HG21 HG23 ' A' ' 30' ' ' VAL . 11.5 t -60.96 -26.1 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 CA-C-O 117.93 -1.033 . . . . 0.0 111.236 -176.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.476 ' HG3' HH11 ' A' ' 21' ' ' ARG . 1.7 ttt85 -66.79 -39.47 87.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 119.933 1.242 . . . . 0.0 110.097 175.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -64.92 123.9 20.63 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.0 -29.16 67.04 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.499 1.119 . . . . 0.0 111.111 176.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.17 -10.13 66.53 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 118.135 -1.369 . . . . 0.0 114.177 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.5 t -71.21 135.62 47.62 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 120.292 2.046 . . . . 0.0 108.05 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.01 -25.99 67.97 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.502 175.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.0 t -75.48 123.69 31.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 105.98 -1.859 . . . . 0.0 105.98 175.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.03 -25.12 3.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 C-N-CA 123.125 0.57 . . . . 0.0 110.333 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.1 p-90 -125.33 147.21 49.23 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 119.113 0.869 . . . . 0.0 109.25 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.543 HG23 HG21 ' A' ' 20' ' ' VAL . 5.5 t -139.83 162.96 25.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 128.032 2.533 . . . . 0.0 107.306 178.139 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 80.7 p -128.33 161.55 29.15 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 175.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -133.6 123.69 25.54 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.5 mmtt -94.37 176.41 6.31 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 176.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -118.93 142.9 47.36 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 175.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -137.1 152.48 50.05 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 175.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 32.86 -98.96 0.01 OUTLIER Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.629 2.061 . . . . 0.0 113.646 176.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.29 39.44 3.25 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.058 1.743 . . . . 0.0 110.467 176.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -142.08 175.69 9.54 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.508 1.123 . . . . 0.0 111.503 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 32.0 mm -107.31 135.52 45.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 104.729 -2.322 . . . . 0.0 104.729 175.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.4 m -129.47 158.05 74.48 Favored Pre-proline 0 N--CA 1.47 0.532 0 CA-C-O 118.741 -0.647 . . . . 0.0 110.472 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.71 165.4 32.84 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 121.962 1.775 . . . . 0.0 110.355 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -134.16 -157.86 8.35 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 125.485 1.517 . . . . 0.0 110.557 176.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.8 mp0 -59.03 158.44 8.57 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 125.212 1.405 . . . . 0.0 109.398 176.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.401 ' HB3' HG22 ' A' ' 30' ' ' VAL . 3.6 pt20 -156.78 155.59 31.84 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.768 1.227 . . . . 0.0 108.107 -176.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.7 -179.15 40.73 Favored Glycine 0 CA--C 1.527 0.782 0 CA-C-O 121.589 0.549 . . . . 0.0 113.156 -175.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.85 -26.24 11.33 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.101 1.36 . . . . 0.0 112.186 177.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -111.77 128.94 56.25 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 -175.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -83.08 -10.61 58.61 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.611 1.964 . . . . 0.0 113.11 -175.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -53.96 -37.98 64.49 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 120.06 1.3 . . . . 0.0 110.572 175.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -69.01 -34.06 74.65 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.413 1.085 . . . . 0.0 111.602 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -58.48 -39.23 79.41 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.559 1.144 . . . . 0.0 109.51 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.9 mm -59.79 -32.55 49.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 123.874 0.87 . . . . 0.0 109.173 -176.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -79.31 -24.05 43.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.034 1.334 . . . . 0.0 112.441 -176.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -80.94 -23.55 38.77 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.634 1.174 . . . . 0.0 112.609 -175.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 79.6 m -79.39 114.47 18.35 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.777 1.231 . . . . 0.0 108.918 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.2 p -130.16 -173.6 3.09 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 122.475 1.131 . . . . 0.0 111.259 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.4 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 9.6 p-10 -40.77 -76.57 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.49 1 C-N-CA 134.673 5.189 . . . . 0.0 117.67 -175.862 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.4 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 17.2 t70 -106.21 -6.46 18.47 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 125.958 1.703 . . . . 0.0 114.077 -175.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.8 m -68.69 131.32 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 O-C-N 120.816 -1.177 . . . . 0.0 110.063 -176.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.6 ptt-85 -103.95 123.51 47.3 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 101.216 -3.624 . . . . 0.0 101.216 175.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.6 tp -141.76 163.21 33.53 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 123.619 0.767 . . . . 0.0 110.01 -175.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -131.48 152.12 50.98 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.509 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -142.32 163.75 32.02 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.315 0.579 . . . . 0.0 111.274 176.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -138.06 123.68 19.75 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 105.3 -2.111 . . . . 0.0 105.3 -176.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.0 t -133.72 138.46 50.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -175.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.1 ttp-105 -80.91 114.9 20.11 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 175.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -131.85 133.33 44.53 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.615 1.166 . . . . 0.0 108.986 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m -95.82 131.77 41.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 122.232 1.015 . . . . 0.0 111.034 -176.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 34.7 m -83.72 132.62 34.84 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 104.673 -2.343 . . . . 0.0 104.673 175.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -37.67 131.72 1.3 Allowed Glycine 0 C--N 1.339 0.7 0 C-N-CA 125.451 1.5 . . . . 0.0 110.798 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -50.43 166.1 0.08 Allowed 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 127.265 2.226 . . . . 0.0 116.898 -175.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.17 -173.21 4.11 Favored 'General case' 0 N--CA 1.447 -0.592 1 C-N-CA 133.072 4.549 . . . . 0.0 103.184 175.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 92.8 mtp -60.59 2.9 0.09 Allowed 'General case' 0 CA--C 1.552 1.021 0 O-C-N 120.651 -1.28 . . . . 0.0 112.706 175.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 69.3 m -146.31 145.36 30.31 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 127.778 2.431 . . . . 0.0 106.788 175.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.3 mmtm -64.5 167.73 6.71 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.49 1.138 . . . . 0.0 112.82 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.48 148.12 42.25 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 175.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.6 t -146.51 123.92 11.67 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 104.513 -2.403 . . . . 0.0 104.513 175.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.6 mttt -135.93 176.37 8.75 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -175.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -132.31 127.17 35.03 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.037 -176.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.57 117.76 34.84 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.883 1.673 . . . . 0.0 106.82 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -87.11 113.31 22.75 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 104.3 -2.481 . . . . 0.0 104.3 175.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mt -98.23 146.55 7.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 -176.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.2 m -126.03 123.58 38.76 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 103.317 -2.846 . . . . 0.0 103.317 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 25.6 t-105 -103.28 123.46 46.82 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 175.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.437 HD11 HG21 ' A' ' 97' ' ' THR . 13.3 mm -143.03 101.44 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 105.386 -2.079 . . . . 0.0 105.386 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -60.42 154.63 33.85 Favored Glycine 0 CA--C 1.535 1.303 0 N-CA-C 108.329 -1.909 . . . . 0.0 108.329 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -74.57 -3.35 30.51 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 120.342 -1.681 . . . . 0.0 111.177 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -82.95 -36.01 25.52 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 120.833 -1.167 . . . . 0.0 109.248 -175.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -70.91 123.82 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 104.921 -2.252 . . . . 0.0 104.921 175.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.9 t -78.52 171.74 14.68 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 122.759 1.266 . . . . 0.0 113.547 -174.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -46.84 -35.36 7.76 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 129.12 3.248 . . . . 0.0 113.661 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 tt -62.49 -57.38 11.41 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 119.937 1.869 . . . . 0.0 110.719 176.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -66.1 -37.77 86.59 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 121.774 -0.579 . . . . 0.0 109.885 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -61.41 -33.1 73.13 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.832 -0.542 . . . . 0.0 110.012 175.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.4 -28.63 69.92 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 117.952 -1.023 . . . . 0.0 111.156 176.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -63.06 -55.47 25.2 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 175.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.437 HG21 HD11 ' A' ' 85' ' ' ILE . 13.0 m -50.33 -47.28 55.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.769 0.827 . . . . 0.0 109.764 175.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -59.62 -25.73 61.42 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.026 0.822 . . . . 0.0 114.263 178.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 49.5 m -103.12 -9.41 19.71 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 127.82 2.448 . . . . 0.0 111.155 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -104.52 -23.56 13.12 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 127.118 2.167 . . . . 0.0 112.238 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -48.36 -36.67 14.97 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 119.896 1.226 . . . . 0.0 113.061 176.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.0 t -59.76 -34.2 72.68 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.828 HD11 ' HB ' ' A' ' 6' ' ' THR . 15.4 mt -68.33 -61.66 1.74 Allowed 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 126.616 1.966 . . . . 0.0 109.963 -176.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.2 p -61.84 -30.4 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 117.502 -1.237 . . . . 0.0 108.489 175.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -41.69 99.52 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 120.76 1.618 . . . . 0.0 109.23 175.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -58.91 -25.63 63.58 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.46 1.027 . . . . 0.0 112.806 177.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 29.9 t -86.04 -54.07 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 59.1 t -76.09 21.93 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 C-N-CA 128.753 2.821 . . . . 0.0 112.218 -175.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -48.83 -22.76 0.88 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.862 1.665 . . . . 0.0 115.309 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -107.29 85.21 2.09 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -147.51 175.26 10.98 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.351 1.86 . . . . 0.0 108.524 176.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.14 -60.37 1.62 Allowed 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -175.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.49 173.76 12.01 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.873 1.269 . . . . 0.0 110.325 -178.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -126.59 158.62 35.78 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.452 1.101 . . . . 0.0 111.034 175.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -138.53 155.42 48.41 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 104.949 -2.241 . . . . 0.0 104.949 -175.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 46.8 t -128.53 130.11 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 175.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.5 mp -132.65 153.15 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 126.468 1.907 . . . . 0.0 107.099 -176.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.6 p -149.26 -9.85 0.32 Allowed 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.451 1.901 . . . . 0.0 114.443 -175.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -129.9 154.92 46.83 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.211 1.005 . . . . 0.0 110.756 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.58 HH12 ' CD ' ' A' ' 124' ' ' GLU . 0.0 OUTLIER -69.49 -29.75 67.47 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.587 -176.586 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -76.48 -46.59 26.11 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 121.501 1.955 . . . . 0.0 107.096 174.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -55.34 -23.9 26.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.916 2.087 . . . . 0.0 112.258 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -79.66 -22.87 42.98 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.747 1.619 . . . . 0.0 113.709 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.58 ' CD ' HH12 ' A' ' 120' ' ' ARG . 18.8 mt-10 -69.74 129.04 38.5 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 116.031 1.863 . . . . 0.0 116.031 -175.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.473 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 14.2 mm-40 -53.09 -17.47 1.58 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 125.538 1.535 . . . . 0.0 114.849 175.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.426 ' HA ' ' NZ ' ' A' ' 129' ' ' LYS 0.36 15.3 t70 -65.11 -57.95 7.29 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 117.657 -1.617 . . . . 0.0 112.756 -175.605 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -77.69 -26.3 50.14 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 117.949 -1.5 . . . . 0.0 109.907 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.473 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 51.7 mt -56.53 -40.89 71.07 Favored 'Isoleucine or valine' 0 C--N 1.344 0.345 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.426 ' NZ ' ' HA ' ' A' ' 126' ' ' ASP . 28.1 mtmm -52.85 -52.35 57.58 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 119.905 1.229 . . . . 0.0 111.283 176.242 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.2 t -73.79 -24.19 59.8 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.622 -178.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -67.63 -49.75 61.42 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 175.206 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.01 -23.9 62.34 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.29 1.036 . . . . 0.0 111.092 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -67.5 -52.93 33.3 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 174.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -53.73 -48.82 69.27 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.588 1.085 . . . . 0.0 110.103 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.27 -7.96 11.15 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.415 1.086 . . . . 0.0 112.378 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -98.48 -62.88 0.86 Allowed Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 107.082 -2.407 . . . . 0.0 107.082 175.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -167.89 -168.93 30.73 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.617 1.103 . . . . 0.0 111.149 -179.206 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.7 172.23 5.49 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.275 0.63 . . . . 0.0 111.398 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -136.92 103.72 5.25 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 103.85 -2.648 . . . . 0.0 103.85 175.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -130.66 116.27 17.84 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 103.013 -2.958 . . . . 0.0 103.013 -176.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -111.93 158.56 19.33 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 128.278 2.631 . . . . 0.0 104.694 175.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -73.74 86.43 1.68 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.79 0.723 . . . . 0.0 110.224 -175.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -136.69 91.41 2.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.065 1.346 . . . . 0.0 109.277 -175.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 86.46 56.4 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 127.307 2.243 . . . . 0.0 110.448 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 . . . . . 0 C--O 1.249 1.067 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 175.464 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.649 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.5 mt -80.4 91.05 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 173.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.17 81.11 1.06 Allowed 'General case' 0 N--CA 1.466 0.332 0 O-C-N 120.999 -1.063 . . . . 0.0 109.778 176.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.18 176.02 9.63 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.641 0.777 . . . . 0.0 111.36 -175.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -137.29 56.26 1.79 Allowed 'General case' 0 C--O 1.236 0.384 0 N-CA-C 105.424 -2.065 . . . . 0.0 105.424 175.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.708 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.4 m -134.29 165.24 25.58 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.035 1.734 . . . . 0.0 106.412 -175.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -128.03 178.45 6.19 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.115 -0.991 . . . . 0.0 111.006 -175.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.417 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -138.19 151.35 24.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 122.732 0.413 . . . . 0.0 110.095 176.639 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -99.74 77.73 2.08 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 103.076 -2.935 . . . . 0.0 103.076 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -24.13 66.46 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.027 -1.463 . . . . 0.0 110.47 -175.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -66.46 -59.88 3.26 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 120.228 1.377 . . . . 0.0 109.799 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.62 93.15 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.979 0.912 . . . . 0.0 109.853 -178.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.473 ' HB3' HG11 ' A' ' 107' ' ' VAL . 62.5 m -66.78 -36.94 83.58 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.361 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 68.9 ttt-85 -63.7 -35.45 80.61 Favored 'General case' 0 C--N 1.345 0.405 0 CA-C-N 119.11 0.868 . . . . 0.0 109.111 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.47 -50.61 72.49 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.526 0.603 . . . . 0.0 109.965 -175.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.525 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -67.39 -44.88 77.82 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.435 0.294 . . . . 0.0 111.781 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -51.35 -39.3 56.77 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.646 1.178 . . . . 0.0 111.444 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -65.9 -42.41 90.24 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.399 0.68 . . . . 0.0 111.258 -178.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.3 mp -61.95 -54.87 35.77 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 123.428 0.691 . . . . 0.0 109.977 175.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.433 ' CG2' HG23 ' A' ' 30' ' ' VAL . 13.6 t -55.67 -36.18 41.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 122.83 0.452 . . . . 0.0 111.131 178.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -65.69 -38.25 88.74 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.129 176.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -76.2 123.18 25.45 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 120.166 1.348 . . . . 0.0 109.515 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -67.77 -19.53 65.11 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 121.338 -0.851 . . . . 0.0 111.289 175.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.88 -11.23 84.09 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.801 1.191 . . . . 0.0 112.538 176.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.8 t -74.13 143.24 45.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 175.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -72.37 -14.58 61.75 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.475 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.6 t -86.19 136.59 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 126.825 2.05 . . . . 0.0 109.12 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.53 -27.36 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.436 1.094 . . . . 0.0 110.127 175.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -130.91 154.2 48.35 Favored 'General case' 0 C--N 1.343 0.318 0 CA-C-N 119.836 1.198 . . . . 0.0 111.261 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.525 HG21 ' HB1' ' A' ' 16' ' ' ALA . 5.7 t -139.33 160.94 28.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 128.32 2.648 . . . . 0.0 107.542 176.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 45.1 p -122.41 153.7 38.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 175.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -123.29 123.94 41.86 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 175.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -106.46 175.98 5.32 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 105.222 -2.14 . . . . 0.0 105.222 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -115.06 152.41 32.55 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 175.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -147.59 124.2 11.1 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 53.24 -84.51 0.01 OUTLIER Glycine 0 CA--C 1.53 1.02 0 C-N-CA 126.003 1.764 . . . . 0.0 114.857 176.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.8 p -136.07 25.25 3.29 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.988 1.315 . . . . 0.0 112.009 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -145.7 169.81 17.73 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 119.177 0.899 . . . . 0.0 112.229 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.3 mm -96.48 138.38 21.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 104.282 -2.488 . . . . 0.0 104.282 175.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.3 m -130.79 147.89 67.96 Favored Pre-proline 0 CA--C 1.531 0.25 0 C-N-CA 122.822 0.449 . . . . 0.0 110.947 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.73 139.99 34.79 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 121.566 1.511 . . . . 0.0 108.457 175.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -110.67 -147.65 11.31 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 125.506 1.527 . . . . 0.0 109.793 176.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -59.28 160.3 6.72 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 123.763 0.825 . . . . 0.0 111.179 175.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -141.28 166.06 25.82 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 126.137 1.775 . . . . 0.0 108.641 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.27 179.41 41.38 Favored Glycine 0 N--CA 1.452 -0.291 0 O-C-N 121.593 -0.692 . . . . 0.0 113.033 -175.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -124.14 -12.8 7.37 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 125.559 1.544 . . . . 0.0 113.476 -175.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -131.98 144.82 51.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -83.5 -9.04 59.22 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.429 0.691 . . . . 0.0 110.518 -174.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -58.31 -37.02 74.24 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.327 -1.483 . . . . 0.0 110.219 175.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 19.4 m80 -76.04 -29.34 58.03 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.261 1.024 . . . . 0.0 110.549 175.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -60.51 -32.87 71.87 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 121.565 -0.71 . . . . 0.0 111.994 178.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.5 mm -57.6 -35.62 51.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.4 mm-40 -71.87 -23.57 61.53 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.287 1.435 . . . . 0.0 112.345 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -65.03 -34.62 78.87 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 120.842 -1.161 . . . . 0.0 110.688 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.63 112.86 19.21 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 -176.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.3 p -113.82 172.53 6.92 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.753 1.621 . . . . 0.0 112.66 -175.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -46.38 -71.36 0.07 Allowed 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 118.267 2.691 . . . . 0.0 118.267 -174.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -106.58 -31.34 8.54 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -175.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.8 m -70.88 153.3 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.95 0 O-C-N 120.991 -1.068 . . . . 0.0 110.896 -175.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.87 148.16 26.47 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 175.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.3 tp -145.93 162.98 36.55 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.478 1.111 . . . . 0.0 109.495 -175.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -128.16 152.51 47.95 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.429 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.96 143.89 29.78 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 118.34 0.518 . . . . 0.0 112.137 176.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -109.88 123.73 50.1 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 176.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.5 t -133.02 138.99 50.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 122.72 0.408 . . . . 0.0 111.564 -175.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -79.95 120.5 24.24 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 104.187 -2.523 . . . . 0.0 104.187 175.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -135.92 164.2 28.49 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 86.0 m -116.38 117.48 30.05 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 -176.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 3.3 m -152.04 158.42 43.03 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.12 164.78 7.32 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 125.081 1.324 . . . . 0.0 111.206 -178.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -142.67 155.17 44.88 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 123.626 0.77 . . . . 0.0 109.264 176.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.35 -173.38 4.17 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.03 2.932 . . . . 0.0 105.516 176.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 86.7 mtp -65.88 7.17 0.29 Allowed 'General case' 0 CA--C 1.551 0.999 0 O-C-N 121.223 -0.923 . . . . 0.0 111.642 175.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.9 m -146.07 176.31 9.81 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 129.569 3.147 . . . . 0.0 106.633 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.5 mmpm? -77.23 175.56 9.58 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 119.828 -1.795 . . . . 0.0 110.188 175.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -136.72 161.28 36.37 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.169 0.987 . . . . 0.0 108.712 -175.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.8 t -144.58 123.75 12.92 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 175.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mtpt -132.06 123.39 27.13 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 -175.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -86.06 129.39 34.86 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.088 -175.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -104.04 126.02 50.84 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -94.78 113.31 25.06 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 102.759 -3.052 . . . . 0.0 102.759 175.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.8 mp -95.13 143.53 11.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.2 m -125.42 123.22 38.8 Favored 'General case' 0 N--CA 1.435 -1.203 0 N-CA-C 102.66 -3.089 . . . . 0.0 102.66 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -99.67 124.52 44.98 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 104.039 -2.578 . . . . 0.0 104.039 175.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.538 HD11 HG21 ' A' ' 97' ' ' THR . 5.2 mt -139.2 78.62 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 178.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -42.75 137.53 3.39 Favored Glycine 0 C--N 1.339 0.725 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -176.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -62.19 -4.07 1.58 Allowed 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 118.369 1.085 . . . . 0.0 112.485 -175.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -83.12 -35.98 25.17 Favored 'General case' 0 CA--C 1.521 -0.153 0 O-C-N 120.402 -1.437 . . . . 0.0 109.889 178.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.9 p -78.35 123.73 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 119.889 1.222 . . . . 0.0 109.084 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.3 t -146.05 123.63 11.78 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 175.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 133.26 -151.11 19.99 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 124.254 0.931 . . . . 0.0 111.084 -175.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -50.4 -38.5 43.23 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 126.193 1.797 . . . . 0.0 111.656 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -61.38 -38.11 85.83 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.169 1.35 . . . . 0.0 111.484 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.0 ttm180 -71.47 -37.29 71.34 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.751 1.16 . . . . 0.0 108.322 175.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.48 -31.57 72.77 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 118.788 -0.625 . . . . 0.0 111.849 178.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -59.51 -54.27 48.47 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 119.457 1.026 . . . . 0.0 108.394 176.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.538 HG21 HD11 ' A' ' 85' ' ' ILE . 15.8 m -52.16 -40.97 62.18 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.573 0.624 . . . . 0.0 110.367 175.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -58.77 -25.83 59.45 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-O 119.736 -0.48 . . . . 0.0 113.768 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 50.8 m -115.16 -0.29 13.33 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.568 1.184 . . . . 0.0 111.657 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -103.49 -23.14 13.54 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.71 1.604 . . . . 0.0 108.775 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -53.33 -24.43 11.87 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 120.111 1.323 . . . . 0.0 110.437 174.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -64.09 -41.99 97.09 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.246 -0.909 . . . . 0.0 110.639 176.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.708 HD11 ' HB ' ' A' ' 6' ' ' THR . 12.4 mt -62.82 -62.23 1.87 Allowed 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 125.363 1.465 . . . . 0.0 109.007 -176.057 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.257 0.9 OUTLIER -57.45 -31.32 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 117.501 -1.237 . . . . 0.0 110.702 176.353 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -60.92 -47.58 85.74 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 121.195 1.816 . . . . 0.0 109.8 175.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -54.37 -24.01 17.88 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.089 0.956 . . . . 0.0 111.539 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.473 HG11 ' HB3' ' A' ' 13' ' ' CYS . 61.5 t -86.15 -65.38 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.653 1.181 . . . . 0.0 108.036 175.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 98.1 t -64.8 25.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.814 1 C-N-CA 131.957 4.103 . . . . 0.0 113.747 -175.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -49.42 -26.6 3.39 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 115.553 1.686 . . . . 0.0 115.553 -175.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -105.49 84.44 2.09 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -138.13 176.52 8.63 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 124.787 1.235 . . . . 0.0 108.293 176.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -104.65 -62.38 1.34 Allowed 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.31 0.644 . . . . 0.0 109.869 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -156.45 175.79 13.55 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 127.554 2.342 . . . . 0.0 106.879 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -117.31 170.58 8.59 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 125.024 1.33 . . . . 0.0 111.077 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -141.67 150.54 42.03 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 105.187 -2.153 . . . . 0.0 105.187 -176.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 65.2 t -124.27 128.7 73.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 175.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.4 mp -129.13 142.15 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 125.562 1.545 . . . . 0.0 107.182 -178.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.6 p -135.13 -3.26 2.48 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 175.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -130.85 149.7 52.36 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.094 1.758 . . . . 0.0 109.652 -175.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 14.0 ttp85 -69.46 -30.64 68.58 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.608 -0.71 . . . . 0.0 111.125 -176.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -73.47 -39.01 65.24 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 120.232 1.378 . . . . 0.0 109.095 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -63.86 -23.7 67.46 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.127 0.971 . . . . 0.0 110.35 175.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -71.93 -22.35 61.48 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.741 -1.224 . . . . 0.0 112.571 176.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -61.28 123.81 18.8 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -176.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.407 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 2.9 mm-40 -56.12 -31.59 63.45 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.232 1.013 . . . . 0.0 113.462 175.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -55.48 -43.28 75.39 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -175.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -94.9 -25.87 16.39 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 119.82 1.191 . . . . 0.0 109.473 176.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.407 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 14.9 mt -51.98 -39.7 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 124.782 1.233 . . . . 0.0 107.995 176.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -51.46 -52.29 47.7 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.764 0.711 . . . . 0.0 110.64 175.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -68.23 -40.62 81.99 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.38 0.536 . . . . 0.0 110.583 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -61.47 -39.21 90.06 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.315 -0.866 . . . . 0.0 111.263 178.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.4 mt -73.08 -40.42 65.03 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.767 1.227 . . . . 0.0 110.314 176.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -56.8 -44.54 82.04 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 175.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.75 -49.23 77.24 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.339 1.055 . . . . 0.0 109.208 175.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.84 -22.62 64.4 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -177.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -56.78 -46.49 89.79 Favored Glycine 0 CA--C 1.529 0.958 0 O-C-N 121.305 -0.872 . . . . 0.0 112.745 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -75.19 92.05 0.84 Allowed Glycine 0 C--N 1.335 0.499 0 N-CA-C 108.827 -1.709 . . . . 0.0 108.827 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -158.33 164.66 36.16 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 118.328 1.064 . . . . 0.0 110.528 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -85.24 93.6 8.71 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.964 1.306 . . . . 0.0 110.088 177.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -155.2 116.33 3.97 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.904 2.082 . . . . 0.0 107.193 -176.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -131.59 157.93 42.34 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.069 1.748 . . . . 0.0 108.909 175.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -153.5 79.41 1.16 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.551 1.54 . . . . 0.0 109.503 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.6 mm-40 -70.65 40.68 0.06 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.984 2.114 . . . . 0.0 112.375 175.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 64.51 23.45 12.91 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.831 1.653 . . . . 0.0 110.507 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 125.136 1.374 . . . . 0.0 109.038 -176.323 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.065 0 CA-C-O 118.791 -1.005 . . . . 0.0 112.695 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.6 pt -144.59 62.34 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 125.528 1.531 . . . . 0.0 108.139 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.95 23.74 11.79 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 120.539 -1.351 . . . . 0.0 112.986 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -86.77 176.31 7.79 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.175 0.898 . . . . 0.0 109.966 175.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -138.99 95.85 3.02 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 104.194 -2.521 . . . . 0.0 104.194 175.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.71 ' HB ' HD11 ' A' ' 103' ' ' LEU . 10.0 m -134.17 178.47 6.94 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.081 1.352 . . . . 0.0 108.328 -175.288 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.3 tttp -127.35 175.45 8.18 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.197 -0.94 . . . . 0.0 111.58 -175.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -139.97 148.2 23.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 C-N-CA 125.993 1.717 . . . . 0.0 107.851 175.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -91.57 79.47 5.48 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 103.478 -2.786 . . . . 0.0 103.478 175.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -60.64 -23.47 64.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 116.92 -1.514 . . . . 0.0 113.577 -175.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.33 -56.79 4.31 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.813 1.642 . . . . 0.0 109.309 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.43 89.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 119.727 -0.178 . . . . 0.0 111.473 -175.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 100.0 m -72.08 -33.85 68.22 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.474 -0.766 . . . . 0.0 111.082 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -24.89 66.52 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 117.856 -1.069 . . . . 0.0 110.704 176.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.68 -59.07 5.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 120.387 1.449 . . . . 0.0 110.146 176.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.34 -39.01 91.7 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.651 -0.656 . . . . 0.0 111.216 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -55.92 -47.11 78.08 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 118.438 -0.792 . . . . 0.0 109.532 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -54.67 -47.15 73.96 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 124.971 1.308 . . . . 0.0 110.351 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.3 mp -60.11 -53.97 51.48 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 118.465 0.575 . . . . 0.0 111.088 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 40.4 t -65.02 -24.28 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 O-C-N 121.19 -0.944 . . . . 0.0 111.352 -178.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -51.59 10.48 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 125.321 1.448 . . . . 0.0 110.719 176.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.68 123.71 21.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.693 0.679 . . . . 0.0 112.442 -175.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -67.84 -9.17 42.26 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.874 0.87 . . . . 0.0 113.101 -176.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -91.43 -0.57 72.96 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 119.438 1.017 . . . . 0.0 112.491 176.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.5 t -80.79 145.46 31.45 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 119.055 1.428 . . . . 0.0 111.029 178.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -80.47 -35.84 34.26 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.0 127.81 27.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 C-N-CA 125.669 1.587 . . . . 0.0 108.264 176.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -115.75 -23.87 3.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 125.002 1.321 . . . . 0.0 110.991 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -124.98 143.34 50.94 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.594 1.158 . . . . 0.0 108.836 -177.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.7 t -137.16 165.25 28.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 127.647 2.379 . . . . 0.0 109.44 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 82.8 p -132.9 156.33 47.42 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.725 1.21 . . . . 0.0 108.125 175.274 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -128.43 124.47 36.32 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 176.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -99.88 176.32 5.48 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -115.85 145.1 43.15 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 104.939 -2.245 . . . . 0.0 104.939 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -133.58 123.52 25.26 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.218 -2.512 . . . . 0.0 104.218 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 36.48 -96.96 0.01 OUTLIER Glycine 0 CA--C 1.533 1.167 0 C-N-CA 126.469 1.985 . . . . 0.0 113.22 -175.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 p -120.18 35.34 4.89 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.681 1.592 . . . . 0.0 113.197 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -146.49 168.74 20.45 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.31 1.044 . . . . 0.0 111.239 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.2 mm -100.14 138.49 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 175.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.7 m -134.08 161.43 63.79 Favored Pre-proline 0 N--CA 1.473 0.706 0 C-N-CA 123.587 0.755 . . . . 0.0 111.688 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.96 155.93 66.94 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 121.896 1.73 . . . . 0.0 108.469 175.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.02 -144.98 7.13 Favored Glycine 0 CA--C 1.52 0.388 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 176.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -68.97 159.64 32.37 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 175.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -141.11 161.84 36.91 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 125.552 1.541 . . . . 0.0 107.349 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.49 -178.21 46.93 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-O 122.393 0.996 . . . . 0.0 113.155 176.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.97 -26.43 4.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.002 1.321 . . . . 0.0 110.313 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -94.9 123.26 38.26 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -83.12 -14.27 53.95 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.201 0.6 . . . . 0.0 110.599 -176.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -57.74 -38.06 74.67 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.561 -1.337 . . . . 0.0 110.065 175.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -68.68 -32.31 72.04 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.645 -0.659 . . . . 0.0 111.575 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -57.98 -31.92 67.38 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.479 1.112 . . . . 0.0 111.025 178.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 mm -63.97 -47.65 89.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -67.78 -23.62 65.23 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.897 0.879 . . . . 0.0 112.799 176.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -67.8 -25.86 65.8 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 119.975 1.261 . . . . 0.0 111.644 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 74.3 m -73.79 112.89 10.34 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.384 0.611 . . . . 0.0 109.654 -175.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.37 2.1 p -105.23 167.28 9.83 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 127.298 2.239 . . . . 0.0 111.437 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -54.12 -76.68 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 -174.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -100.76 -28.25 12.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 119.685 1.129 . . . . 0.0 113.574 -174.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.0 m -58.77 137.71 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 O-C-N 121.276 -0.89 . . . . 0.0 109.619 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.11 134.9 47.45 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 105.09 -2.189 . . . . 0.0 105.09 175.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.8 tp -130.19 161.99 29.9 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 124.684 1.194 . . . . 0.0 109.801 -175.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.411 ' CE2' HG11 ' A' ' 104' ' ' VAL . 11.6 m-85 -120.52 140.83 50.88 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -130.44 146.16 51.95 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 124.01 0.924 . . . . 0.0 108.856 176.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -123.74 123.62 40.91 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 103.562 -2.755 . . . . 0.0 103.562 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 t -138.07 146.61 26.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 118.917 0.781 . . . . 0.0 110.414 -175.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 20.2 ttm180 -79.69 123.99 28.16 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -128.82 170.75 12.99 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.917 1.287 . . . . 0.0 109.183 176.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 90.6 m -119.33 115.32 23.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 125.106 1.362 . . . . 0.0 107.864 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.9 m -151.83 141.99 22.28 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.346 -0.846 . . . . 0.0 110.645 176.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 87.61 157.18 31.14 Favored Glycine 0 CA--C 1.525 0.67 0 C-N-CA 126.116 1.817 . . . . 0.0 108.575 -177.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -135.77 141.16 44.77 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -176.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.47 -173.35 4.17 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 127.343 2.257 . . . . 0.0 106.942 175.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 58.4 mmm -64.94 -6.22 7.96 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.037 0.535 . . . . 0.0 111.28 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.4 m -132.52 166.92 20.96 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 129.61 3.164 . . . . 0.0 105.902 175.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -71.12 175.91 4.87 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 122.36 1.076 . . . . 0.0 108.937 175.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -132.52 150.21 52.19 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 175.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.1 t -125.12 128.92 49.18 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 103.511 -2.774 . . . . 0.0 103.511 175.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -136.08 123.91 22.6 Favored 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -177.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -91.6 128.11 37.3 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.589 -175.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -103.62 121.57 43.2 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 -176.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.79 113.37 23.39 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 105.048 -2.205 . . . . 0.0 105.048 175.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.0 mp -96.15 138.86 20.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 176.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -122.68 123.29 40.79 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 104.269 -2.493 . . . . 0.0 104.269 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 63.8 t-105 -92.13 123.33 35.4 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 104.224 -2.51 . . . . 0.0 104.224 175.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.463 HD11 HG21 ' A' ' 97' ' ' THR . 6.0 mt -150.16 92.06 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 176.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -57.63 174.97 2.01 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 123.933 0.778 . . . . 0.0 113.183 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -86.51 -9.24 56.59 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.47 -1.018 . . . . 0.0 110.67 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -83.86 -31.74 25.61 Favored 'General case' 0 C--O 1.238 0.475 0 O-C-N 121.022 -1.049 . . . . 0.0 109.142 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -65.7 146.39 13.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 118.73 0.695 . . . . 0.0 110.739 -177.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 39.9 t -74.62 151.78 39.31 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 125.602 1.561 . . . . 0.0 110.812 -177.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.2 -28.87 69.82 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 123.907 0.765 . . . . 0.0 111.469 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.2 tt -62.39 -47.96 81.81 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 118.284 1.042 . . . . 0.0 109.653 176.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -65.46 -46.47 79.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.697 -0.668 . . . . 0.0 109.853 175.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.01 -27.9 61.99 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.45 1.023 . . . . 0.0 111.82 177.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.64 -36.68 85.03 Favored 'General case' 0 C--O 1.234 0.272 0 O-C-N 120.7 -1.25 . . . . 0.0 112.104 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -57.02 -46.42 82.37 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 118.641 -0.695 . . . . 0.0 109.515 176.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.463 HG21 HD11 ' A' ' 85' ' ' ILE . 7.2 m -55.38 -42.46 74.0 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 123.66 0.784 . . . . 0.0 109.781 -177.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -70.66 -26.35 74.21 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 119.195 0.907 . . . . 0.0 113.135 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 86.0 m -86.05 -15.95 39.67 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.768 1.227 . . . . 0.0 111.419 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -103.5 -23.73 13.49 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 127.458 2.303 . . . . 0.0 113.225 -175.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -50.0 -27.91 6.16 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.29 1.405 . . . . 0.0 113.004 176.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.2 t -62.88 -38.64 91.68 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.499 1.045 . . . . 0.0 112.072 176.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.71 HD11 ' HB ' ' A' ' 6' ' ' THR . 12.4 mt -65.17 -61.33 2.2 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 125.419 1.488 . . . . 0.0 109.658 -176.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 104' ' ' VAL 0.257 0.8 OUTLIER -58.63 -28.96 38.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-O 118.117 -0.944 . . . . 0.0 109.262 175.636 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.01 -39.52 94.3 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 120.534 1.515 . . . . 0.0 109.653 175.503 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -54.52 -32.37 58.01 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 120.19 1.359 . . . . 0.0 112.988 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 52.5 t -86.44 -60.01 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 125.123 1.369 . . . . 0.0 111.022 176.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 3.5 t -74.32 26.62 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 129.193 2.997 . . . . 0.0 113.545 -175.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -53.61 -13.58 0.68 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 120.183 -1.573 . . . . 0.0 114.169 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -94.99 29.43 2.41 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.113 1.324 . . . . 0.0 113.08 175.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.37 174.12 9.32 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 175.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -123.69 -45.62 2.03 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.672 -0.642 . . . . 0.0 110.974 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.72 175.6 8.67 Favored 'General case' 0 C--O 1.235 0.29 1 C-N-CA 131.842 4.057 . . . . 0.0 106.333 175.811 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -132.1 171.4 13.68 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.82 0.848 . . . . 0.0 111.267 -178.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -146.85 149.98 34.35 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 40.3 t -123.62 124.22 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 175.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.7 mt -122.12 146.01 27.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 125.701 1.6 . . . . 0.0 109.521 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 12.8 p -140.08 -8.45 1.18 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.493 1.294 . . . . 0.0 114.493 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -137.41 154.4 49.97 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.743 1.156 . . . . 0.0 109.32 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 29.1 ttp-105 -50.6 -46.53 58.01 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 124.165 0.986 . . . . 0.0 110.733 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -63.45 -38.19 90.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 118.587 0.63 . . . . 0.0 110.295 -176.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -72.62 -23.92 61.0 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.81 1.244 . . . . 0.0 110.491 177.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -79.57 -23.72 42.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.923 1.689 . . . . 0.0 111.527 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -69.77 123.56 21.74 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.099 1.318 . . . . 0.0 110.543 -176.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.1 -13.87 14.03 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.813 1.245 . . . . 0.0 113.717 -178.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -56.09 -65.93 0.52 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.363 1.865 . . . . 0.0 112.802 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -77.34 -25.86 51.49 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 118.263 -1.375 . . . . 0.0 108.815 -175.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 19.5 mt -50.21 -41.17 18.46 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 C-N-CA 125.569 1.548 . . . . 0.0 108.444 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 33.4 mttp -55.95 -56.33 21.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.582 -0.723 . . . . 0.0 111.054 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 43.4 t -67.76 -33.27 74.53 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.613 1.097 . . . . 0.0 110.754 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -60.86 -52.79 63.56 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.583 1.083 . . . . 0.0 109.791 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.8 mt -59.87 -41.05 90.67 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 124.656 1.183 . . . . 0.0 111.125 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -62.55 -52.58 62.87 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 123.645 0.778 . . . . 0.0 110.804 176.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -61.61 -45.84 92.35 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 119.331 0.969 . . . . 0.0 109.182 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.73 -0.03 6.36 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.508 1.123 . . . . 0.0 111.693 175.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -59.94 -26.37 63.03 Favored Glycine 0 CA--C 1.527 0.811 0 O-C-N 120.586 -1.321 . . . . 0.0 111.433 176.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -110.32 90.14 0.57 Allowed Glycine 0 C--N 1.337 0.602 0 N-CA-C 107.949 -2.06 . . . . 0.0 107.949 175.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -145.71 109.97 4.97 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 105.477 -2.045 . . . . 0.0 105.477 175.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -145.69 103.61 3.8 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -176.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -135.15 101.41 4.85 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.506 1.522 . . . . 0.0 110.32 -175.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.98 165.63 18.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.464 1.906 . . . . 0.0 110.479 175.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -144.82 136.14 25.21 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 127.022 2.129 . . . . 0.0 108.941 -178.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -127.55 94.64 4.02 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.544 1.065 . . . . 0.0 110.029 176.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.6 m 57.43 38.21 28.16 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.378 1.071 . . . . 0.0 111.016 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 . . . . . 0 C--O 1.248 1.012 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 175.427 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.217 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.8 pp -135.81 152.95 31.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-N 117.981 0.891 . . . . 0.0 111.022 -172.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 63.1 ttt-85 -150.96 166.65 29.99 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 106.166 -1.79 . . . . 0.0 106.166 175.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -67.53 24.78 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 127.058 2.143 . . . . 0.0 115.052 -175.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -122.76 43.99 2.77 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 123.195 1.474 . . . . 0.0 110.865 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.654 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.7 m -89.85 162.51 15.44 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 125.522 1.529 . . . . 0.0 107.868 176.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -133.45 -172.01 2.85 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 120.962 -1.086 . . . . 0.0 111.202 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.18 151.78 29.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 125.409 1.484 . . . . 0.0 108.964 175.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -86.7 79.0 9.0 Favored 'General case' 0 N--CA 1.464 0.272 1 N-CA-C 99.399 -4.297 . . . . 0.0 99.399 174.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.9 pttm -54.05 -35.4 61.97 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -74.49 -44.03 53.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 119.372 0.987 . . . . 0.0 109.469 -175.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.67 -45.86 73.99 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 118.13 0.423 . . . . 0.0 111.537 176.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 84.8 m -69.88 -41.6 74.56 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 119.382 -0.342 . . . . 0.0 110.574 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 -64.39 -32.29 73.85 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 116.631 -1.652 . . . . 0.0 109.777 175.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.87 -53.64 52.99 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 120.69 1.586 . . . . 0.0 110.029 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.443 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -56.23 -47.37 78.59 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.976 0.807 . . . . 0.0 110.98 176.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -55.54 -44.04 76.37 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.137 0.426 . . . . 0.0 111.005 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.54 -46.89 88.51 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 125.429 1.492 . . . . 0.0 109.612 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.2 mp -60.72 -46.57 89.88 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.789 0.722 . . . . 0.0 110.163 175.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.75 -39.38 81.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 123.598 0.759 . . . . 0.0 110.301 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -48.55 78.22 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -54.41 135.72 44.91 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 123.024 1.392 . . . . 0.0 113.032 -175.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -86.03 -22.69 27.12 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.679 1.992 . . . . 0.0 110.297 -178.545 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.35 -8.15 86.69 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.005 0.812 . . . . 0.0 112.947 176.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.7 t -81.21 139.62 35.41 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 118.653 1.226 . . . . 0.0 108.815 176.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -76.8 -35.65 57.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.311 0.644 . . . . 0.0 110.206 175.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.3 t -57.07 133.22 21.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 124.174 0.99 . . . . 0.0 108.935 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.09 -24.41 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 123.217 0.607 . . . . 0.0 109.656 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 49.3 p-90 -130.31 145.99 51.84 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 119.897 1.226 . . . . 0.0 110.366 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.443 HG11 ' HB1' ' A' ' 16' ' ' ALA . 49.9 t -137.28 168.42 21.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 175.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.43 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 76.5 p -132.02 161.01 34.23 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 175.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -135.19 123.9 23.77 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.76 -2.311 . . . . 0.0 104.76 -177.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -99.17 175.85 5.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 106.722 -1.585 . . . . 0.0 106.722 -176.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.448 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 24.0 m-85 -119.85 139.19 52.76 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 177.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -140.21 123.16 16.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 47.23 -98.47 0.01 OUTLIER Glycine 0 CA--C 1.526 0.768 0 C-N-CA 125.043 1.306 . . . . 0.0 113.818 -176.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 p -120.6 25.15 9.93 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.86 2.464 . . . . 0.0 111.745 -175.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -149.34 166.27 29.51 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.448 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 36.4 mm -92.88 133.1 35.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 175.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.7 m -126.7 160.95 55.97 Favored Pre-proline 0 N--CA 1.468 0.457 0 C-N-CA 123.406 0.682 . . . . 0.0 110.741 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.21 167.37 26.99 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 121.463 1.442 . . . . 0.0 109.11 175.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -139.23 -140.58 3.97 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.222 1.392 . . . . 0.0 112.13 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -66.86 156.42 35.73 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 126.749 2.02 . . . . 0.0 110.228 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -149.29 158.27 44.03 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 125.02 1.328 . . . . 0.0 110.14 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -173.39 174.68 46.12 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 123.91 0.767 . . . . 0.0 112.672 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.77 -8.9 7.85 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.72 1.608 . . . . 0.0 112.686 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.22 135.1 55.19 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 104.278 -2.49 . . . . 0.0 104.278 177.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.401 ' CE1' ' CD2' ' A' ' 51' ' ' PHE . 41.0 t80 -86.29 -14.67 43.0 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -175.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -55.28 -44.86 76.07 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.474 1.488 . . . . 0.0 109.532 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -62.68 -22.97 66.88 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.256 1.022 . . . . 0.0 112.028 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.401 ' CD2' ' CE1' ' A' ' 48' ' ' TYR . 0.7 OUTLIER -62.51 -55.54 26.53 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.766 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.02 -33.52 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.138 0.575 . . . . 0.0 109.815 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -62.49 -48.18 80.7 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -74.17 -22.43 59.42 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 -175.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 86.9 m -51.57 119.97 4.69 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 121.481 1.946 . . . . 0.0 110.727 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 p -101.54 164.18 11.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.458 1.503 . . . . 0.0 113.178 -175.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -49.77 -70.58 0.08 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 130.658 3.583 . . . . 0.0 119.251 -174.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -106.53 -36.49 6.75 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 124.845 1.258 . . . . 0.0 114.217 -175.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.6 m -58.39 145.36 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 CA-C-O 122.432 1.111 . . . . 0.0 110.397 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.72 139.64 38.69 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 175.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.4 tp -141.38 160.0 41.05 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -126.55 123.52 37.9 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 105.057 -2.201 . . . . 0.0 105.057 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.43 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -104.45 162.23 13.42 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 175.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -137.25 123.15 20.12 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 102.188 -3.264 . . . . 0.0 102.188 178.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.8 t -129.21 134.52 63.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -175.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 41.2 ttt85 -77.1 113.54 14.94 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 105.115 -2.18 . . . . 0.0 105.115 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -116.64 173.77 6.44 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 126.368 1.867 . . . . 0.0 108.963 -175.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 37.0 m -133.52 117.14 16.79 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 121.278 -0.889 . . . . 0.0 109.887 -176.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 m -156.44 155.46 32.12 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 93.23 113.63 2.25 Favored Glycine 0 CA--C 1.501 -0.822 0 N-CA-C 105.121 -3.192 . . . . 0.0 105.121 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -109.95 122.5 47.7 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 110.62 -2.79 . . . . 0.0 108.461 -175.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.58 -173.79 4.3 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 126.047 1.739 . . . . 0.0 108.108 177.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 54.8 mtt -61.21 -1.21 0.44 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.131 1.772 . . . . 0.0 111.709 175.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.8 m -145.93 147.89 32.22 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 128.011 2.524 . . . . 0.0 105.366 175.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -69.26 167.05 17.14 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -138.44 167.9 20.91 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -177.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.3 t -125.58 158.37 34.8 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 175.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.5 mmmt -144.22 171.78 13.83 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 127.048 2.139 . . . . 0.0 107.475 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -144.53 123.88 13.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.532 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.94 129.24 56.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 126.054 1.742 . . . . 0.0 108.432 -176.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -98.57 113.8 25.99 Favored 'General case' 0 C--O 1.222 -0.342 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 175.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.1 mt -103.63 137.57 31.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 -177.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -116.05 122.89 46.51 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 175.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.0 t-105 -97.04 123.29 40.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 103.833 -2.654 . . . . 0.0 103.833 175.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.1 mt -145.56 98.12 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 176.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -59.94 162.86 16.18 Favored Glycine 0 CA--C 1.53 0.992 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -76.08 -6.41 51.0 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 121.07 -1.253 . . . . 0.0 110.998 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -83.2 -35.98 25.03 Favored 'General case' 0 C--N 1.341 0.231 0 O-C-N 121.423 -0.798 . . . . 0.0 109.589 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.7 p -71.56 127.62 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 176.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 48.3 t -63.32 153.44 34.94 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 124.28 1.032 . . . . 0.0 110.805 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -51.28 -29.94 23.71 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 125.678 1.608 . . . . 0.0 113.054 176.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.95 -51.66 69.11 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.355 1.078 . . . . 0.0 110.232 176.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -70.28 -31.49 68.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 118.51 -0.757 . . . . 0.0 110.036 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -63.41 -28.84 70.25 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.757 1.162 . . . . 0.0 109.273 175.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.89 -24.13 61.91 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.569 1.148 . . . . 0.0 111.958 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.36 -35.4 69.9 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 118.787 0.721 . . . . 0.0 110.481 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.7 m -54.8 -33.35 61.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.345 1.058 . . . . 0.0 110.146 175.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.33 -14.27 61.67 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 125.547 1.546 . . . . 0.0 114.481 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 30.0 m -123.18 -3.87 8.48 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.462 1.631 . . . . 0.0 109.894 175.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -103.79 -37.97 7.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 123.919 0.888 . . . . 0.0 112.684 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.5 mtmp? -57.18 -36.9 71.37 Favored 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 120.257 1.39 . . . . 0.0 111.376 -176.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -56.87 -34.06 67.46 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 120.255 1.388 . . . . 0.0 112.046 177.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.654 HD11 ' HB ' ' A' ' 6' ' ' THR . 39.9 mt -66.21 -65.17 0.71 Allowed 'General case' 0 CA--C 1.508 -0.653 0 C-N-CA 125.887 1.675 . . . . 0.0 109.137 -176.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.1 p -57.73 -32.96 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-O 117.846 -1.073 . . . . 0.0 108.519 175.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -67.48 -24.31 65.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 121.144 1.793 . . . . 0.0 111.32 178.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.68 -27.22 66.66 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.92 1.236 . . . . 0.0 110.302 175.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 89.4 t -85.73 -56.68 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 175.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.1 t -70.09 17.35 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 130.17 3.388 . . . . 0.0 112.278 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -57.49 -26.71 61.7 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 119.406 -2.059 . . . . 0.0 111.027 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -94.9 72.35 3.48 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 125.247 1.419 . . . . 0.0 107.521 176.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -143.79 176.21 9.42 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.521 0.728 . . . . 0.0 110.209 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.68 -66.15 0.94 Allowed 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.772 0.829 . . . . 0.0 111.549 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -155.49 176.27 12.81 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.376 2.27 . . . . 0.0 111.778 -175.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -122.95 163.86 19.59 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.975 0.91 . . . . 0.0 111.212 175.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -138.67 147.75 43.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 -175.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.5 t -118.27 123.32 71.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 3.0 mt -132.44 143.27 40.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -176.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 7.7 p -143.24 -0.59 1.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.566 1.146 . . . . 0.0 112.679 -176.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -139.24 157.03 46.63 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.053 1.741 . . . . 0.0 108.846 -175.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -73.54 -41.67 62.68 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.823 -176.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -62.55 -34.37 76.81 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 120.136 1.335 . . . . 0.0 109.429 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -65.48 -23.3 66.87 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.785 1.634 . . . . 0.0 110.768 175.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -86.44 -23.53 26.0 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.657 1.183 . . . . 0.0 113.888 -176.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -57.15 123.84 16.67 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.711 1.204 . . . . 0.0 110.753 -176.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.97 -23.82 66.63 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.529 ' HA ' ' CE ' ' A' ' 129' ' ' LYS 0.356 10.5 t70 -57.69 -52.16 66.59 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 121.454 1.934 . . . . 0.0 113.526 -175.437 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -74.35 -23.15 58.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 116.821 -1.952 . . . . 0.0 109.019 -177.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 56.6 mt -55.78 -41.8 67.43 Favored 'Isoleucine or valine' 0 C--N 1.347 0.473 0 CA-C-N 119.283 0.947 . . . . 0.0 108.519 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.529 ' CE ' ' HA ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -54.73 -51.23 66.29 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 119.91 1.232 . . . . 0.0 111.434 175.588 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.9 t -71.25 -31.39 67.48 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.058 -175.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 36.1 tp10 -63.93 -46.51 84.46 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.612 1.165 . . . . 0.0 108.798 175.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 91.2 mt -66.18 -31.01 71.59 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.555 -0.716 . . . . 0.0 110.412 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? -65.98 -49.13 68.92 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.488 1.04 . . . . 0.0 108.317 175.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 39.9 mtmt -56.46 -45.06 81.04 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.824 0.738 . . . . 0.0 110.117 176.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.6 1.63 3.03 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.358 1.463 . . . . 0.0 114.029 176.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -146.83 -103.94 0.37 Allowed Glycine 0 C--N 1.335 0.496 0 N-CA-C 108.413 -1.875 . . . . 0.0 108.413 176.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.28 173.96 43.46 Favored Glycine 0 CA--C 1.526 0.72 0 C-N-CA 123.969 0.795 . . . . 0.0 111.17 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -159.5 -178.11 6.89 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.557 2.343 . . . . 0.0 106.66 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -127.2 65.18 1.31 Allowed 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 175.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -145.29 112.78 6.23 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.095 -2.187 . . . . 0.0 105.095 -176.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -145.92 171.08 15.35 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 129.17 2.988 . . . . 0.0 103.297 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -148.24 136.24 21.05 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 121.349 1.886 . . . . 0.0 114.167 -175.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -83.31 25.78 0.7 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.493 1.917 . . . . 0.0 110.112 175.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 86.43 56.57 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 128.639 2.776 . . . . 0.0 106.012 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 . . . . . 0 C--O 1.249 1.029 0 C-N-CA 129.018 2.927 . . . . 0.0 105.427 -176.1 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.632 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.5 mp -143.22 145.09 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.27 125.17 38.33 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 175.587 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.96 151.31 44.07 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 118.71 0.686 . . . . 0.0 110.53 -176.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -101.51 64.1 0.99 Allowed 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.503 ' HB ' HD11 ' A' ' 103' ' ' LEU . 3.2 m -143.05 166.44 24.63 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.065 1.746 . . . . 0.0 106.805 -175.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.5 tttm -130.14 -178.66 4.83 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 124.137 0.975 . . . . 0.0 109.799 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.407 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -135.56 147.81 28.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 176.254 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -89.91 73.06 7.47 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 175.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -31.6 69.84 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-O 118.108 -0.949 . . . . 0.0 109.649 -176.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -63.74 -56.85 12.48 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.26 0.936 . . . . 0.0 109.394 -177.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.18 -43.27 82.6 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 122.27 -0.268 . . . . 0.0 110.846 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 79.9 m -68.91 -28.14 66.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.436 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -61.5 -38.86 88.86 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.527 176.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.44 -56.3 23.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 119.358 0.981 . . . . 0.0 109.771 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.412 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -61.06 -42.93 99.42 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.862 -0.524 . . . . 0.0 111.268 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -53.34 -48.48 68.45 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 175.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -61.56 -47.01 87.45 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 124.93 1.292 . . . . 0.0 110.348 -176.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -63.74 -27.39 69.17 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.422 ' CG2' HG23 ' A' ' 30' ' ' VAL . 6.6 t -83.53 -33.27 9.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 118.889 0.768 . . . . 0.0 109.948 175.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -70.56 -44.69 66.89 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.493 1.917 . . . . 0.0 111.743 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -70.83 123.49 22.1 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.646 1.578 . . . . 0.0 113.162 -175.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -72.21 -11.83 60.9 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.705 0.802 . . . . 0.0 110.217 175.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.74 -26.6 62.47 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 125.514 1.531 . . . . 0.0 111.705 175.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.2 t -85.92 150.24 24.64 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.915 1.686 . . . . 0.0 108.709 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.93 -14.58 44.3 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.215 0.606 . . . . 0.0 111.723 175.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.6 t -70.53 133.54 31.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -176.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.31 -24.06 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 118.456 -0.783 . . . . 0.0 111.44 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 55.0 p-90 -131.61 153.15 50.22 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 120.014 1.279 . . . . 0.0 110.83 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.422 HG23 ' CG2' ' A' ' 20' ' ' VAL . 4.7 t -140.86 164.37 21.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 129.663 3.185 . . . . 0.0 109.122 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 39.2 p -128.82 158.56 38.36 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.366 1.466 . . . . 0.0 107.883 175.219 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -133.56 123.69 25.58 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.5 mtpt -99.63 176.9 5.32 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 175.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -117.53 144.13 45.39 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 175.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -142.83 156.47 44.95 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 175.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 35.92 -104.7 0.03 OUTLIER Glycine 0 CA--C 1.53 0.992 0 C-N-CA 125.742 1.639 . . . . 0.0 112.065 -175.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.6 p -129.89 41.96 3.35 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 127.443 2.297 . . . . 0.0 109.456 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.9 t -149.55 172.73 14.54 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.113 0.965 . . . . 0.0 112.349 -175.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.5 mm -99.62 140.03 19.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 175.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.7 m -129.85 156.57 78.76 Favored Pre-proline 0 N--CA 1.469 0.514 0 C-N-CA 123.436 0.694 . . . . 0.0 110.551 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -71.46 154.35 60.57 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.812 1.674 . . . . 0.0 109.98 175.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -126.28 -158.21 9.82 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 125.738 1.637 . . . . 0.0 109.703 176.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -53.17 157.55 1.83 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 126.607 1.963 . . . . 0.0 111.468 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.2 pm0 -144.57 169.86 17.17 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.269 1.428 . . . . 0.0 109.885 177.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -172.61 166.47 39.16 Favored Glycine 0 CA--C 1.522 0.48 0 CA-C-O 122.222 0.901 . . . . 0.0 112.76 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -99.23 -18.51 17.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.239 1.416 . . . . 0.0 110.548 175.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 49' ' ' GLN . 4.9 tp10 -129.2 139.02 52.03 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 176.034 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.419 ' CE1' ' CD2' ' A' ' 51' ' ' PHE . 53.8 t80 -83.82 -5.18 59.15 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.633 1.973 . . . . 0.0 113.077 -175.117 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.42 ' H ' ' HG3' ' A' ' 47' ' ' GLU . 18.2 tt0 -57.72 -36.85 72.58 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 120.62 -1.3 . . . . 0.0 110.958 176.034 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -65.77 -39.9 91.49 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.943 0.897 . . . . 0.0 110.504 176.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.419 ' CD2' ' CE1' ' A' ' 48' ' ' TYR . 33.2 t80 -56.97 -34.94 68.57 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 125.223 1.409 . . . . 0.0 112.029 -176.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 mm -60.03 -35.75 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 24.8 mm100 -85.86 -24.15 26.81 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.429 1.492 . . . . 0.0 112.457 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -67.48 -24.66 65.62 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 118.942 0.792 . . . . 0.0 111.467 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 78.0 m -75.21 113.42 12.54 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.311 2.1 p -92.89 171.23 9.1 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.595 1.558 . . . . 0.0 112.667 -175.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -47.21 -74.65 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 118.118 2.636 . . . . 0.0 118.118 -174.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -107.51 -35.62 6.7 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 127.323 2.249 . . . . 0.0 115.965 -174.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.4 m -54.93 155.53 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 N-CA-C 114.714 1.376 . . . . 0.0 114.714 -175.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 26.7 ptt-85 -103.99 135.32 45.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.6 tp -142.74 165.71 26.64 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 125.989 1.716 . . . . 0.0 107.249 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -131.41 154.55 48.53 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.488 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -136.45 151.97 50.07 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 123.581 0.752 . . . . 0.0 111.222 176.084 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -123.46 123.57 40.95 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 104.191 -2.522 . . . . 0.0 104.191 175.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.9 t -130.36 139.27 51.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 122.866 0.467 . . . . 0.0 109.879 -175.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -86.8 126.61 34.73 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 106.179 -1.785 . . . . 0.0 106.179 175.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -136.11 168.36 19.52 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -175.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m -127.13 114.22 17.43 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 120.717 -1.239 . . . . 0.0 108.066 175.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 m -144.17 147.39 33.61 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 105.78 118.57 4.45 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 125.274 1.416 . . . . 0.0 110.997 175.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -77.67 121.86 24.55 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 124.669 1.188 . . . . 0.0 108.068 -177.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.26 173.25 12.4 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 125.25 1.42 . . . . 0.0 108.836 175.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 93.7 mtp -73.35 3.63 5.67 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.809 0.843 . . . . 0.0 111.379 175.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.3 m -143.28 168.79 18.97 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 128.288 2.635 . . . . 0.0 106.821 176.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -67.13 165.45 15.92 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -133.31 153.96 51.12 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 105.667 -1.975 . . . . 0.0 105.667 175.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 t -129.59 123.93 32.53 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 176.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 49.5 mttt -132.49 145.54 51.25 Favored 'General case' 0 CA--C 1.503 -0.864 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -114.65 144.68 43.04 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.439 -0.8 . . . . 0.0 108.981 -175.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -116.24 121.22 41.4 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 -178.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -91.02 113.36 25.6 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 102.251 -3.24 . . . . 0.0 102.251 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -103.05 143.93 14.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -122.43 123.53 41.53 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 104.737 -2.32 . . . . 0.0 104.737 175.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.8 t-105 -100.78 124.03 45.83 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 104.033 -2.58 . . . . 0.0 104.033 175.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.2 mm -127.12 98.62 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 175.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -44.22 126.85 6.38 Favored Glycine 0 C--N 1.342 0.867 0 N-CA-C 107.008 -2.437 . . . . 0.0 107.008 176.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -54.5 -7.64 0.17 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 -175.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -83.56 -35.87 24.41 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.755 1.622 . . . . 0.0 112.454 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.4 p -75.07 135.75 26.58 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 CA-C-N 121.029 1.74 . . . . 0.0 111.62 -175.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.0 t -146.4 176.7 9.59 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.821 1.248 . . . . 0.0 108.909 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 81.05 -142.58 23.37 Favored Glycine 0 CA--C 1.521 0.443 0 O-C-N 121.654 -0.654 . . . . 0.0 113.062 175.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 9.2 tt -53.18 -44.66 68.09 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 124.791 1.237 . . . . 0.0 110.578 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -60.83 -35.55 76.82 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.115 0.566 . . . . 0.0 110.953 -177.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.8 ttt-85 -70.7 -44.56 66.7 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.209 -0.932 . . . . 0.0 108.542 175.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.69 68.87 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.184 0.594 . . . . 0.0 112.444 177.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -58.62 -54.71 44.0 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 175.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.0 m -51.7 -45.67 63.59 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 119.513 1.051 . . . . 0.0 109.974 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -60.4 -25.88 63.43 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-O 119.91 -0.383 . . . . 0.0 113.729 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.8 m -101.4 -9.83 20.77 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.058 1.743 . . . . 0.0 111.232 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -103.84 -23.81 13.36 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 126.134 1.773 . . . . 0.0 112.462 -175.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 42.1 mtpt -54.25 -31.84 54.53 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.466 1.484 . . . . 0.0 112.035 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 5.4 t -66.84 -29.4 69.31 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.288 0.949 . . . . 0.0 112.226 175.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.503 HD11 ' HB ' ' A' ' 6' ' ' THR . 10.7 mt -68.21 -63.55 1.04 Allowed 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 125.169 1.388 . . . . 0.0 108.758 -176.21 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.36 -29.02 41.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 118.04 -0.981 . . . . 0.0 108.741 175.586 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.6 tttp -65.82 -27.34 68.18 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 120.87 1.668 . . . . 0.0 110.72 175.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -65.02 -27.51 68.86 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 121.224 1.829 . . . . 0.0 111.107 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 72.8 t -85.71 -48.87 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 175.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 65.6 t -84.46 26.07 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 128.796 2.838 . . . . 0.0 111.15 -175.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -56.93 -26.32 59.23 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 121.246 1.839 . . . . 0.0 110.942 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -90.08 80.66 6.3 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.954 1.702 . . . . 0.0 106.867 175.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -148.6 176.31 10.44 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 175.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.42 -64.69 1.26 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.899 0.88 . . . . 0.0 111.789 -175.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -132.03 172.32 12.51 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.353 1.461 . . . . 0.0 110.366 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -125.89 164.54 20.52 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.757 1.223 . . . . 0.0 108.234 175.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -150.96 146.07 26.01 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 103.831 -2.655 . . . . 0.0 103.831 -175.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.7 t -122.98 123.82 68.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 3.3 mt -129.41 150.82 34.99 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 125.459 1.504 . . . . 0.0 108.76 -175.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.0 p -151.27 0.34 0.38 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.34 1.056 . . . . 0.0 113.804 177.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.455 ' OD1' ' HE2' ' A' ' 121' ' ' LYS . 5.0 t70 -126.03 145.87 50.13 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.15 1.38 . . . . 0.0 108.906 -175.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 45.4 ttt85 -65.46 -33.93 77.08 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.455 ' HE2' ' OD1' ' A' ' 119' ' ' ASP . 7.4 mtmm -68.78 -45.64 70.8 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 120.125 1.33 . . . . 0.0 108.169 175.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.02 -23.77 62.25 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.466 1.907 . . . . 0.0 111.596 -179.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -78.16 -22.85 48.09 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.571 1.948 . . . . 0.0 113.782 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -69.99 129.84 40.57 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.562 1.528 . . . . 0.0 113.592 -176.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -57.92 -25.79 61.35 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.082 1.353 . . . . 0.0 113.715 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -53.61 -55.04 29.24 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 123.869 0.868 . . . . 0.0 112.495 -176.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -86.37 -23.86 26.02 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 118.517 -1.273 . . . . 0.0 109.029 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 64.4 mt -55.06 -40.13 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 175.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -52.14 -54.27 32.66 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.977 0.808 . . . . 0.0 110.012 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.4 ' HA ' ' HE3' ' A' ' 133' ' ' LYS . 4.2 t -69.0 -36.03 77.36 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.957 -0.544 . . . . 0.0 111.27 -177.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -64.3 -39.46 93.97 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.991 1.269 . . . . 0.0 110.054 176.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 67.5 mt -69.78 -30.52 68.1 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 120.94 -1.1 . . . . 0.0 110.1 175.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 130' ' ' SER . 8.0 mtmp? -67.25 -45.94 75.22 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 175.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -57.21 -55.78 30.27 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.0 -25.98 46.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.407 1.083 . . . . 0.0 111.811 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -76.42 83.08 1.01 Allowed Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 175.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 117.91 -18.87 11.37 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 125.729 1.633 . . . . 0.0 112.837 177.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.86 99.83 1.1 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.415 1.108 . . . . 0.0 110.629 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -124.55 110.02 13.95 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -134.77 97.33 3.74 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -147.12 81.81 1.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -141.35 136.56 31.6 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 124.107 0.963 . . . . 0.0 110.772 -175.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -133.43 148.2 51.76 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 124.525 1.13 . . . . 0.0 109.135 176.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.0 m 59.01 23.49 11.63 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.036 1.734 . . . . 0.0 110.598 177.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 . . . . . 0 C--O 1.256 1.417 0 C-N-CA 128.284 2.634 . . . . 0.0 107.624 -177.983 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.707 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.8 tp -153.45 113.37 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 117.994 0.897 . . . . 0.0 108.712 175.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -83.67 113.97 21.24 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -177.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 9.5 ptm -149.77 175.5 11.54 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.141 0.577 . . . . 0.0 110.491 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -147.87 65.84 1.11 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.75 1.22 . . . . 0.0 109.47 175.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.603 ' HB ' HD11 ' A' ' 103' ' ' LEU . 5.0 m -121.99 176.1 5.97 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.215 1.806 . . . . 0.0 106.575 178.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -137.86 -179.22 5.64 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.733 -1.23 . . . . 0.0 113.584 -175.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.23 148.6 32.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 C-N-CA 124.522 1.129 . . . . 0.0 108.891 175.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -94.43 76.73 3.88 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 102.455 -3.165 . . . . 0.0 102.455 175.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.6 ttpt -60.26 -27.22 67.06 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 118.047 -0.978 . . . . 0.0 112.812 -175.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -69.35 -57.96 4.62 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 119.588 1.085 . . . . 0.0 109.927 176.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.96 -40.58 83.18 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.758 0.708 . . . . 0.0 110.982 -178.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.6 m -67.68 -29.84 69.21 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 121.369 -0.832 . . . . 0.0 111.4 -178.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.7 ttt85 -60.65 -33.18 72.43 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-O 117.418 -1.277 . . . . 0.0 109.508 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.63 -51.48 69.23 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 120.126 1.33 . . . . 0.0 110.118 -179.02 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.515 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -60.49 -49.71 76.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 121.913 -0.492 . . . . 0.0 110.835 178.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -56.27 -38.92 71.82 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.051 0.54 . . . . 0.0 111.196 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -62.93 -55.88 22.04 Favored 'General case' 0 CA--C 1.522 -0.126 0 C-N-CA 124.854 1.262 . . . . 0.0 110.046 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mp -59.84 -32.17 70.43 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 81.6 t -75.62 -34.55 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-N 118.487 0.585 . . . . 0.0 109.528 176.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -72.33 -42.72 65.07 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 119.271 0.942 . . . . 0.0 111.239 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.64 136.64 57.19 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 126.408 1.883 . . . . 0.0 114.022 -175.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.412 ' CG ' HH22 ' A' ' 66' ' ' ARG . 0.8 OUTLIER -86.27 -21.91 27.1 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.539 1.536 . . . . 0.0 113.049 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.24 -33.07 36.86 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 108.789 -1.725 . . . . 0.0 108.789 175.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 t -66.4 123.72 20.77 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 175.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -78.04 -6.76 55.58 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.144 0.578 . . . . 0.0 111.442 175.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.6 t -70.17 127.42 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 175.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.04 -23.82 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 CA-C-O 118.376 -0.821 . . . . 0.0 109.716 175.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 38.6 p-90 -130.71 140.46 50.35 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.737 1.153 . . . . 0.0 110.701 178.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.515 HG11 ' HB1' ' A' ' 16' ' ' ALA . 35.0 t -139.59 152.3 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 175.244 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 37.2 p -103.56 158.8 16.11 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.249 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -127.91 123.97 36.24 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -110.63 176.33 5.08 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -176.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -119.54 140.66 50.17 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 177.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -141.01 136.02 31.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 55.59 -96.35 0.04 OUTLIER Glycine 0 CA--C 1.531 1.045 0 CA-C-N 119.001 0.819 . . . . 0.0 111.654 -178.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.2 p -136.26 28.74 3.08 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.31 1.844 . . . . 0.0 111.333 175.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.8 t -143.92 163.66 32.81 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 -175.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.2 mm -83.67 138.94 18.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.0 m -134.26 159.43 72.33 Favored Pre-proline 0 C--N 1.329 -0.309 0 C-N-CA 124.765 1.226 . . . . 0.0 109.534 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.42 162.08 36.57 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 CA-C-N 120.801 1.322 . . . . 0.0 108.887 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -127.61 -165.0 11.78 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 126.263 1.887 . . . . 0.0 109.832 175.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -56.06 159.27 3.43 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.723 1.209 . . . . 0.0 110.914 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -145.2 168.21 20.94 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.184 1.394 . . . . 0.0 111.843 -175.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.1 -174.62 43.69 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 122.23 0.906 . . . . 0.0 112.328 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.41 -21.06 7.61 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.998 1.719 . . . . 0.0 110.992 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -106.24 117.36 33.83 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.571 1.148 . . . . 0.0 108.695 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -82.79 -16.09 49.17 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.24 0.616 . . . . 0.0 110.151 -177.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -62.57 -27.28 69.07 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 119.545 -1.972 . . . . 0.0 109.964 175.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -76.07 -31.4 58.75 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.74 1.216 . . . . 0.0 111.05 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -57.51 -35.97 70.94 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 125.009 1.323 . . . . 0.0 110.383 178.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.7 mm -58.58 -33.68 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 -176.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -77.78 -24.02 49.0 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.485 1.114 . . . . 0.0 112.213 177.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -72.3 -24.09 61.27 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 119.804 1.184 . . . . 0.0 112.091 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.5 m -65.97 132.97 49.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.772 0.715 . . . . 0.0 109.763 -177.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.256 2.1 p -112.95 163.5 14.59 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.696 1.998 . . . . 0.0 110.622 -176.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -50.05 -76.38 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 130.224 3.41 . . . . 0.0 117.314 -175.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -102.67 -36.09 8.45 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 123.669 0.788 . . . . 0.0 112.667 -175.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.4 m -56.73 147.98 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 CA-C-O 122.264 1.03 . . . . 0.0 112.078 -175.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.443 ' H ' ' NE ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -103.58 136.42 43.34 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.454 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 41.4 tp -138.19 167.81 21.05 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.918 1.287 . . . . 0.0 108.088 -176.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -132.39 146.97 52.35 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -144.45 124.49 13.59 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 118.39 0.541 . . . . 0.0 109.87 175.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.427 ' CE1' HG13 ' A' ' 108' ' ' VAL . 26.6 t80 -90.31 123.67 34.27 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 175.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.3 t -133.96 140.86 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 121.397 0.617 . . . . 0.0 109.764 -175.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.412 HH22 ' CG ' ' A' ' 23' ' ' ASP . 48.7 ttt180 -84.73 139.0 32.3 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.37 1.468 . . . . 0.0 108.667 175.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -136.2 150.24 48.91 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.159 1.384 . . . . 0.0 108.508 -176.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 99.3 m -96.95 113.46 25.0 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.0 m -156.76 153.66 28.73 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 121.004 -1.06 . . . . 0.0 110.289 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 117.18 167.73 14.5 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 126.461 1.981 . . . . 0.0 111.808 175.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -134.77 116.88 15.36 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.634 0.774 . . . . 0.0 111.097 -175.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.655 ' HB2' ' HE ' ' A' ' 76' ' ' ARG . . . -146.82 176.72 9.67 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 127.293 2.237 . . . . 0.0 105.788 174.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 25.5 mmt -70.6 6.68 1.33 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.608 0.763 . . . . 0.0 111.137 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.3 m -146.43 173.7 12.05 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.337 2.255 . . . . 0.0 108.84 175.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -63.3 163.59 10.28 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.852 0.834 . . . . 0.0 109.662 175.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.655 ' HE ' ' HB2' ' A' ' 72' ' ' ALA . 8.4 mmt85 -128.29 167.72 16.52 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 126.25 1.82 . . . . 0.0 108.096 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.3 t -133.24 142.48 48.56 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.0 mmtp -141.5 172.15 13.08 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 125.939 1.696 . . . . 0.0 108.002 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -145.55 130.03 17.85 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -177.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.83 119.02 33.61 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.69 113.24 21.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 103.295 -2.854 . . . . 0.0 103.295 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -85.28 132.89 30.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 176.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -116.46 123.28 47.11 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 101.873 -3.38 . . . . 0.0 101.873 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.1 t-105 -102.29 126.87 49.41 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 106.325 -1.732 . . . . 0.0 106.325 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.4 HG21 ' HG3' ' A' ' 94' ' ' ARG . 8.5 mt -138.48 102.0 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 N-CA-C 104.471 -2.418 . . . . 0.0 104.471 175.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.91 125.13 37.87 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 105.992 -2.843 . . . . 0.0 105.992 175.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -55.68 -3.88 0.09 Allowed 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 119.95 1.875 . . . . 0.0 115.003 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 -82.97 -31.35 27.64 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 120.596 -1.315 . . . . 0.0 109.723 177.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.9 p -69.58 136.66 25.75 Favored 'Isoleucine or valine' 0 C--N 1.343 0.31 0 CA-C-N 120.306 1.412 . . . . 0.0 109.588 176.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.3 t -144.04 177.01 8.87 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.306 1.442 . . . . 0.0 108.702 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.02 -145.3 49.63 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 176.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.68 -42.32 78.84 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 124.557 1.143 . . . . 0.0 110.901 -176.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -59.83 -43.42 94.57 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 119.215 0.916 . . . . 0.0 110.06 -176.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.4 ' HG3' HG21 ' A' ' 85' ' ' ILE . 12.5 ttp180 -69.64 -44.21 71.07 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.425 -0.797 . . . . 0.0 109.069 175.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.58 -23.47 50.95 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.144 0.978 . . . . 0.0 112.548 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -51.24 -53.82 31.68 Favored 'General case' 0 CA--C 1.504 -0.808 0 CA-C-N 119.772 1.169 . . . . 0.0 108.356 175.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.3 m -57.05 -41.04 77.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.737 0.699 . . . . 0.0 111.558 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.78 -18.78 64.51 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-N 118.161 0.437 . . . . 0.0 112.843 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.6 m -103.41 -17.74 15.12 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.416 1.086 . . . . 0.0 111.677 176.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -103.05 -23.99 13.65 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 117.755 2.502 . . . . 0.0 117.755 -174.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.2 mtmt -50.12 -28.01 6.61 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 122.212 2.278 . . . . 0.0 114.089 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.5 t -62.92 -35.5 80.3 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.119 1.327 . . . . 0.0 111.657 176.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.603 HD11 ' HB ' ' A' ' 6' ' ' THR . 22.6 mt -61.73 -64.54 0.91 Allowed 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 126.554 1.942 . . . . 0.0 109.054 -176.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.409 HG12 ' H ' ' A' ' 104' ' ' VAL . 0.9 OUTLIER -56.92 -32.73 40.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.343 175.87 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -26.34 64.89 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 120.748 1.613 . . . . 0.0 111.793 175.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -64.38 -28.19 69.53 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 120.719 -1.238 . . . . 0.0 110.165 175.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 95.5 t -86.6 -65.59 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 125.338 1.455 . . . . 0.0 108.294 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.427 HG13 ' CE1' ' A' ' 64' ' ' PHE . 19.9 t -67.58 27.4 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.882 1 C-N-CA 132.97 4.508 . . . . 0.0 113.464 -175.687 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -52.63 -26.15 12.81 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.184 -1.573 . . . . 0.0 114.309 -175.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -104.83 95.22 5.73 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -150.66 163.33 38.78 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.298 1.039 . . . . 0.0 108.95 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.81 -66.69 0.58 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.83 163.46 5.01 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 131.493 3.917 . . . . 0.0 105.836 175.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -85.6 173.16 10.36 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 122.521 0.328 . . . . 0.0 111.018 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -129.59 157.45 42.05 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.5 t -116.95 123.81 72.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 175.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mt -132.06 126.71 56.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . 0.382 2.8 p -126.6 1.22 6.85 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 115.848 1.796 . . . . 0.0 115.848 175.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -146.17 158.03 43.86 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.802 0.841 . . . . 0.0 110.358 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -55.49 -42.25 74.14 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.836 175.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.42 -27.56 67.58 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 120.561 1.528 . . . . 0.0 112.612 178.195 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -83.37 -23.97 32.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.518 1.127 . . . . 0.0 110.751 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -75.56 -23.79 56.59 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.014 2.126 . . . . 0.0 113.091 -178.005 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -68.8 123.18 20.24 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -175.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.417 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 4.0 mm-40 -50.69 -32.12 18.41 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 115.973 1.842 . . . . 0.0 115.973 175.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -56.3 -32.31 64.48 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -108.03 -21.54 12.77 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.45 1.023 . . . . 0.0 108.589 175.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.417 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 46.8 mt -56.15 -36.97 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 175.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -58.73 -53.67 55.71 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.771 -0.581 . . . . 0.0 110.345 176.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 9.1 t -64.65 -31.79 73.17 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.135 0.879 . . . . 0.0 111.89 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -65.29 -52.89 51.19 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 124.997 1.319 . . . . 0.0 109.146 176.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 47.3 mt -60.88 -34.72 75.05 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.499 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -62.13 -52.98 61.67 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.194 0.906 . . . . 0.0 108.846 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 26.5 mmtt -54.28 -52.58 60.99 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.413 0.685 . . . . 0.0 110.928 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.48 -26.24 66.27 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.49 122.62 10.92 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 124.163 0.887 . . . . 0.0 112.264 -175.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -139.22 169.01 24.67 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 125.341 1.448 . . . . 0.0 109.571 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.87 122.16 10.21 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 125.028 1.331 . . . . 0.0 111.372 -176.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -153.34 110.14 3.42 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 105.424 -2.065 . . . . 0.0 105.424 175.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -136.52 71.49 1.42 Allowed 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 122.702 1.239 . . . . 0.0 107.669 176.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -69.58 114.71 8.05 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 113.553 -1.658 . . . . 0.0 108.388 -176.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -73.99 112.91 10.57 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -133.08 143.03 49.06 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.382 1.073 . . . . 0.0 108.442 -175.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 62.53 50.0 3.77 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.732 1.213 . . . . 0.0 110.73 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 125.448 1.499 . . . . 0.0 107.569 175.6 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.805 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -142.14 173.28 7.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 127.218 2.207 . . . . 0.0 107.757 176.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -63.73 127.99 33.81 Favored 'General case' 0 CA--C 1.521 -0.146 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.97 175.9 9.25 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.685 0.794 . . . . 0.0 111.214 178.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -133.8 56.35 1.85 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.032 1.333 . . . . 0.0 110.706 -179.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.573 ' HB ' HD11 ' A' ' 103' ' ' LEU . 3.4 m -110.38 170.74 7.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.335 1.854 . . . . 0.0 106.07 175.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -125.09 172.71 9.25 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.778 -1.201 . . . . 0.0 110.819 -176.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.419 ' HA ' ' H ' ' A' ' 39' ' ' ILE . 0.1 OUTLIER -142.68 153.4 17.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 C-N-CA 124.582 1.153 . . . . 0.0 109.29 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -94.6 73.37 3.71 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 102.69 -3.078 . . . . 0.0 102.69 175.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 31.4 pttt -58.88 -27.84 65.57 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 117.454 -1.26 . . . . 0.0 111.448 -175.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.2 -56.39 5.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.191 0.997 . . . . 0.0 110.068 -175.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.78 -35.45 77.07 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 121.2 -0.2 . . . . 0.0 110.684 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.0 m -69.46 -34.21 74.05 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 118.534 -0.746 . . . . 0.0 110.363 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 76.0 ttt-85 -60.09 -39.63 86.82 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.846 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.62 -59.0 5.31 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 123.878 0.737 . . . . 0.0 109.489 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.41 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -64.14 -36.7 84.89 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.873 -0.517 . . . . 0.0 112.121 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.417 ' CE1' ' HA ' ' A' ' 108' ' ' VAL . 17.7 t80 -62.2 -28.77 69.91 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.181 0.992 . . . . 0.0 111.207 175.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -74.89 -46.37 36.49 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 124.264 1.025 . . . . 0.0 109.376 175.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.5 mp -57.13 -56.39 22.35 Favored 'General case' 0 C--O 1.221 -0.396 0 O-C-N 121.586 -0.696 . . . . 0.0 110.627 175.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.9 t -59.45 -29.08 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 118.494 0.588 . . . . 0.0 111.13 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -69.94 -45.43 67.49 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 119.992 1.269 . . . . 0.0 111.224 175.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -63.36 123.65 19.25 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.994 1.718 . . . . 0.0 111.311 -175.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -64.81 -27.85 69.16 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.975 1.31 . . . . 0.0 111.992 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.15 -11.31 76.27 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 124.4 1.0 . . . . 0.0 112.669 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -62.08 128.75 37.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 119.046 1.423 . . . . 0.0 108.461 176.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.26 -35.78 82.1 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.8 t -72.5 126.26 32.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 125.42 1.488 . . . . 0.0 108.23 175.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.3 pp -113.72 -23.68 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 124.967 1.307 . . . . 0.0 111.062 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -128.08 145.63 50.94 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.784 0.72 . . . . 0.0 109.975 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.41 HG21 ' HB1' ' A' ' 16' ' ' ALA . 9.5 t -135.83 161.82 37.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 126.482 1.913 . . . . 0.0 107.636 176.621 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.447 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 14.2 p -119.54 159.26 24.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.377 1.071 . . . . 0.0 108.939 175.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -137.09 127.8 27.11 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.378 1.471 . . . . 0.0 107.254 -177.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -113.74 176.75 4.9 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 127.074 2.15 . . . . 0.0 107.805 -178.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -118.91 138.22 52.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 175.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -137.48 132.43 33.3 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 59.12 -107.43 1.2 Allowed Glycine 0 CA--C 1.529 0.945 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -175.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.1 p -130.09 29.84 4.87 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.899 1.279 . . . . 0.0 111.704 175.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -130.37 169.1 15.91 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.635 0.652 . . . . 0.0 110.215 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.419 ' H ' ' HA ' ' A' ' 8' ' ' ILE . 38.5 mm -94.98 138.33 21.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 104.21 -2.515 . . . . 0.0 104.21 175.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.3 m -130.81 154.32 81.86 Favored Pre-proline 0 C--N 1.329 -0.309 0 C-N-CA 124.067 0.947 . . . . 0.0 110.326 176.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -75.81 159.66 38.21 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 C-N-CA 121.986 1.791 . . . . 0.0 109.386 175.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -130.62 -162.77 10.8 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 127.201 2.334 . . . . 0.0 108.965 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -58.93 166.92 1.78 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 126.2 1.8 . . . . 0.0 111.723 -176.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.74 171.31 16.44 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 124.749 1.219 . . . . 0.0 111.127 -175.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -171.97 -178.06 41.98 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 123.763 0.697 . . . . 0.0 111.891 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.3 -26.69 7.08 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.871 1.268 . . . . 0.0 111.378 176.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -105.81 130.26 53.82 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 105.672 -1.973 . . . . 0.0 105.672 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.419 ' CE2' ' CD2' ' A' ' 51' ' ' PHE . 21.6 t80 -82.84 -9.47 59.31 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.511 0.724 . . . . 0.0 110.413 -175.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -54.22 -33.73 59.0 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.329 -1.482 . . . . 0.0 110.607 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.4 m80 -68.27 -25.04 64.97 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.305 1.442 . . . . 0.0 112.772 176.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.419 ' CD2' ' CE2' ' A' ' 48' ' ' TYR . 0.6 OUTLIER -62.84 -52.41 63.24 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.158 -0.964 . . . . 0.0 108.842 178.393 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.41 -40.31 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -178.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -61.23 -32.81 72.59 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.172 0.989 . . . . 0.0 112.362 175.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -81.27 -23.59 37.86 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 117.857 -1.068 . . . . 0.0 113.563 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 92.4 m -53.62 114.35 1.5 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 120.183 1.356 . . . . 0.0 111.756 -175.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.25 2.0 p -83.91 164.8 19.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.91 2.084 . . . . 0.0 112.153 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -55.34 -77.12 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 131.153 3.781 . . . . 0.0 120.645 -175.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -106.56 -20.79 13.26 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 127.042 2.137 . . . . 0.0 114.673 -174.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.0 m -68.11 168.67 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-O 122.484 1.135 . . . . 0.0 113.388 -175.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.75 123.37 42.51 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 103.109 -2.923 . . . . 0.0 103.109 175.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 42.7 tp -130.65 168.12 17.66 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.864 2.066 . . . . 0.0 109.072 -175.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -132.5 155.45 48.55 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 123.547 0.739 . . . . 0.0 109.679 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -146.23 137.25 24.41 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.272 0.629 . . . . 0.0 110.86 176.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -104.91 123.83 48.42 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 105.864 -1.902 . . . . 0.0 105.864 175.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.7 t -133.11 136.52 55.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 -175.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.3 ttp-105 -80.83 134.44 35.78 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -136.1 159.75 40.75 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.835 0.854 . . . . 0.0 108.97 -175.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.7 m -111.04 113.42 25.95 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 120.612 -1.305 . . . . 0.0 109.137 -177.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 14.6 m -155.99 163.6 39.51 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 175.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 91.79 157.21 33.46 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 108.248 -1.941 . . . . 0.0 108.248 -175.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -138.5 133.42 32.65 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.171 0.588 . . . . 0.0 109.754 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -145.98 -174.01 4.31 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 127.64 2.376 . . . . 0.0 108.113 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 63.1 mtm -76.46 -6.35 51.38 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.266 -0.896 . . . . 0.0 111.228 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.0 m -126.06 164.23 21.31 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 127.224 2.21 . . . . 0.0 107.49 175.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -62.99 157.47 21.81 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -122.15 162.66 20.9 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 -176.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.2 t -138.87 142.13 38.6 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 106.255 -1.757 . . . . 0.0 106.255 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -143.8 173.97 11.22 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 127.271 2.228 . . . . 0.0 106.525 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -146.35 139.04 25.37 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.83 121.39 43.85 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 175.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.96 113.35 25.59 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 101.52 -3.511 . . . . 0.0 101.52 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mp -94.31 144.37 9.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 -178.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -124.05 123.45 40.38 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 103.186 -2.894 . . . . 0.0 103.186 175.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -100.11 128.63 46.16 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 105.129 -2.174 . . . . 0.0 105.129 175.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.0 mt -131.84 103.64 7.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 102.723 -3.065 . . . . 0.0 102.723 175.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -55.42 122.84 28.03 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 106.8 -2.52 . . . . 0.0 106.8 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -55.0 -3.61 0.05 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.561 1.544 . . . . 0.0 114.154 -175.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -83.53 -23.84 31.89 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.692 1.597 . . . . 0.0 110.343 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.9 p -85.87 144.98 8.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-N 120.714 1.597 . . . . 0.0 108.884 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.6 t -146.3 176.56 9.67 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 126.21 1.804 . . . . 0.0 107.41 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 61.04 -146.9 47.55 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 123.312 0.482 . . . . 0.0 113.54 176.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.3 tt -47.11 -51.39 18.0 Favored 'General case' 0 C--N 1.335 -0.029 0 C-N-CA 126.079 1.752 . . . . 0.0 113.504 -175.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.45 -38.36 86.91 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 120.277 1.399 . . . . 0.0 111.174 -178.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.2 ttt180 -65.78 -47.65 74.46 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 175.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.83 -27.02 66.27 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.613 1.165 . . . . 0.0 112.991 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -50.82 -42.53 58.4 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 120.34 1.427 . . . . 0.0 110.281 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.7 m -54.62 -35.6 63.59 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 124.783 1.233 . . . . 0.0 110.256 -177.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.93 -26.33 74.48 Favored Glycine 0 CA--C 1.526 0.77 0 O-C-N 121.499 -0.75 . . . . 0.0 112.817 179.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.8 m -95.39 -8.69 34.9 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.545 1.538 . . . . 0.0 111.016 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -104.22 -29.66 10.68 Favored 'General case' 0 CA--C 1.514 -0.417 0 O-C-N 121.044 -1.035 . . . . 0.0 111.771 -175.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.1 mtpt -52.82 -35.24 56.79 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 118.932 0.787 . . . . 0.0 110.686 176.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.8 t -62.91 -37.64 87.77 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.73 0.695 . . . . 0.0 111.947 176.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.573 HD11 ' HB ' ' A' ' 6' ' ' THR . 7.0 mt -63.43 -60.02 3.92 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 124.388 1.075 . . . . 0.0 109.665 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.85 -30.96 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 117.726 -1.131 . . . . 0.0 109.886 176.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.66 -46.47 88.93 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 120.337 1.426 . . . . 0.0 109.887 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -56.32 -25.07 47.59 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 77.8 t -85.29 -62.51 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.417 ' HA ' ' CE1' ' A' ' 17' ' ' TYR . 21.2 t -68.77 27.25 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.887 1 C-N-CA 131.864 4.065 . . . . 0.0 113.706 -175.454 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -54.12 -26.55 28.03 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 119.789 -1.819 . . . . 0.0 115.098 -175.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -94.87 81.38 3.76 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 175.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -142.04 170.79 15.05 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 125.406 1.482 . . . . 0.0 108.752 176.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -87.55 -66.58 0.9 Allowed 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.71 176.24 12.62 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 128.856 2.863 . . . . 0.0 106.26 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.46 169.39 9.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.827 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -141.04 149.57 41.85 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 103.927 -2.62 . . . . 0.0 103.927 -175.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 48.4 t -121.94 128.67 75.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.7 mt -133.38 148.78 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 125.632 1.573 . . . . 0.0 107.976 -176.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 79.4 p -145.19 1.69 0.97 Allowed 'General case' 0 C--O 1.235 0.29 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -127.2 136.45 52.05 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 125.612 1.565 . . . . 0.0 107.387 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.43 -50.49 40.51 Favored 'General case' 0 CA--C 1.517 -0.302 0 C-N-CA 123.945 0.898 . . . . 0.0 110.683 177.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -33.92 76.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 118.01 0.368 . . . . 0.0 110.504 -175.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -67.51 -23.32 65.45 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.937 1.295 . . . . 0.0 110.781 175.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -85.1 -23.91 28.28 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 125.315 1.446 . . . . 0.0 112.728 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -58.45 123.81 17.46 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.21 0.914 . . . . 0.0 109.671 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.552 ' HB3' ' HE3' ' A' ' 129' ' ' LYS . 27.5 mt-10 -65.35 -19.54 66.0 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 121.35 -0.844 . . . . 0.0 113.274 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -51.98 -51.43 57.31 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.139 0.881 . . . . 0.0 112.779 -175.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -85.62 -24.31 27.18 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.045 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 41.9 mt -56.92 -38.59 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 119.783 1.174 . . . . 0.0 108.376 175.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.552 ' HE3' ' HB3' ' A' ' 125' ' ' GLU . 41.4 mttt -52.94 -50.64 63.63 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.196 0.598 . . . . 0.0 109.783 176.179 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.5 t -66.0 -35.31 80.21 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.184 1.394 . . . . 0.0 112.064 176.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -63.7 -47.88 79.37 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.285 0.948 . . . . 0.0 109.201 176.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.77 -34.34 77.03 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.976 0.91 . . . . 0.0 109.88 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -65.57 -42.89 91.28 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.103 0.865 . . . . 0.0 109.274 175.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? -61.72 -52.83 62.64 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.641 0.776 . . . . 0.0 109.756 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -76.03 20.23 0.2 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.202 1.001 . . . . 0.0 112.499 176.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -71.39 178.85 34.03 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 124.228 0.918 . . . . 0.0 111.443 -176.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 93.33 119.93 2.92 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -176.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -163.68 169.03 19.07 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 126.828 2.051 . . . . 0.0 107.981 175.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -153.54 105.5 2.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 175.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -143.22 104.61 4.3 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 102.841 -3.022 . . . . 0.0 102.841 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.3 t0 -63.68 143.94 57.43 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 123.751 0.82 . . . . 0.0 110.647 -175.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -85.44 100.93 12.2 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 103.611 -2.737 . . . . 0.0 103.611 175.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -104.95 159.59 15.69 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 -176.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 64.06 38.64 8.36 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.855 1.262 . . . . 0.0 109.688 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 117.713 -1.137 . . . . 0.0 110.436 175.939 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.835 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.6 mp -114.58 -83.45 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.5 ptt-85 -143.8 164.12 31.4 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.594 1.558 . . . . 0.0 108.507 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 7.5 tpt -156.09 165.06 37.55 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.228 0.922 . . . . 0.0 108.786 175.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -76.01 59.1 1.26 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.831 1.252 . . . . 0.0 111.406 176.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.2 m -134.72 168.78 18.39 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 127.239 2.215 . . . . 0.0 105.797 176.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 45.4 tttm -138.51 172.54 12.73 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 120.642 -1.286 . . . . 0.0 108.836 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.431 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -122.84 149.52 26.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.004 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -83.23 85.03 7.28 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 103.432 -2.803 . . . . 0.0 103.432 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -62.54 -23.72 67.13 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.484 -1.246 . . . . 0.0 113.119 -175.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -79.13 -57.5 3.7 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 119.874 1.215 . . . . 0.0 108.112 179.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.17 -35.61 81.36 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.714 -176.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 82.9 m -80.04 -32.77 39.47 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 119.054 0.843 . . . . 0.0 111.037 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.7 ttt-85 -66.78 -26.86 67.17 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 117.328 -1.32 . . . . 0.0 109.713 175.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.89 -62.46 1.65 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 120.44 1.473 . . . . 0.0 109.441 176.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.428 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -54.79 -47.59 73.8 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.289 0.636 . . . . 0.0 111.431 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -52.15 -46.92 65.61 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 122.44 0.296 . . . . 0.0 110.965 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -64.41 -40.74 96.36 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.1 -0.953 . . . . 0.0 111.35 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.7 mp -60.4 -61.38 2.64 Favored 'General case' 0 C--O 1.221 -0.419 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 175.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.1 t -58.15 -32.96 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 122.806 0.442 . . . . 0.0 111.914 -175.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.85 -26.35 63.23 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 119.234 0.925 . . . . 0.0 110.9 176.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -76.02 127.41 32.9 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 118.986 0.812 . . . . 0.0 110.201 -177.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -61.37 -28.18 69.05 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.808 -0.557 . . . . 0.0 111.113 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.78 1.37 78.82 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.578 1.085 . . . . 0.0 113.627 178.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.8 t -85.98 124.9 32.95 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 120.627 2.213 . . . . 0.0 107.856 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.4 -33.12 71.01 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.9 t -64.73 131.01 30.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 C-N-CA 125.067 1.347 . . . . 0.0 107.389 175.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.3 pp -114.19 -23.62 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.448 1.499 . . . . 0.0 111.037 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.1 p-90 -131.74 146.89 52.41 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 118.814 0.733 . . . . 0.0 111.201 178.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.428 HG11 ' HB1' ' A' ' 16' ' ' ALA . 39.9 t -141.46 150.25 19.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 175.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.415 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 38.8 p -103.62 161.74 13.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -130.79 137.96 49.69 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 105.886 -1.894 . . . . 0.0 105.886 175.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -125.61 177.04 6.46 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 126.664 1.985 . . . . 0.0 107.396 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -118.52 137.28 53.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -133.96 123.83 25.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 175.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 58.3 -80.81 0.01 OUTLIER Glycine 0 CA--C 1.529 0.925 0 C-N-CA 126.005 1.764 . . . . 0.0 113.896 176.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.53 10.03 3.71 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.747 2.419 . . . . 0.0 113.664 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -149.82 173.24 13.97 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 120.266 1.394 . . . . 0.0 113.047 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 18.6 mm -84.28 140.03 16.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 175.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.4 m -131.17 160.52 66.63 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 125.482 1.513 . . . . 0.0 110.781 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.55 156.53 36.21 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.497 2.131 . . . . 0.0 109.94 175.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -126.46 -166.83 12.3 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 126.141 1.829 . . . . 0.0 109.532 175.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -54.05 161.67 1.18 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 117.948 0.874 . . . . 0.0 112.891 175.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.79 164.71 29.46 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 127.582 2.353 . . . . 0.0 110.653 -175.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -167.03 172.73 42.2 Favored Glycine 0 CA--C 1.525 0.675 0 CA-C-O 121.837 0.687 . . . . 0.0 111.652 176.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -111.93 -2.7 15.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.647 1.179 . . . . 0.0 112.663 -176.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -139.47 150.41 45.14 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -83.6 -9.85 58.64 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.755 0.707 . . . . 0.0 111.875 -175.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -58.49 -39.57 80.38 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 120.597 -1.314 . . . . 0.0 110.252 175.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -76.21 -14.41 60.15 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.986 1.315 . . . . 0.0 112.781 176.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -72.84 -36.8 67.54 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 123.552 0.741 . . . . 0.0 110.147 175.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.7 mm -55.76 -44.97 79.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.31 0.644 . . . . 0.0 109.841 -175.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -61.72 -23.56 66.22 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.358 1.063 . . . . 0.0 113.495 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -70.99 -30.92 67.31 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.628 1.104 . . . . 0.0 112.1 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 56.7 m -72.25 113.58 9.44 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 105.513 -2.032 . . . . 0.0 105.513 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.265 2.5 p -115.31 166.82 11.44 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.646 1.178 . . . . 0.0 113.273 -175.241 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -40.47 -69.45 0.13 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 131.008 3.723 . . . . 0.0 119.286 -174.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -106.05 -36.21 7.01 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.535 1.934 . . . . 0.0 115.974 -174.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 33.7 m -69.06 167.44 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-O 123.244 1.497 . . . . 0.0 114.615 -175.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.66 145.37 38.07 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 103.206 -2.887 . . . . 0.0 103.206 174.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.2 tp -144.33 165.05 29.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 119.869 1.213 . . . . 0.0 107.751 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.456 ' CZ ' HG23 ' A' ' 97' ' ' THR . 5.3 m-85 -130.89 152.58 50.07 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 176.142 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -152.97 135.51 15.18 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 119.037 0.835 . . . . 0.0 112.412 175.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -95.83 123.18 39.3 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 104.906 -2.257 . . . . 0.0 104.906 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 50.3 t -133.87 137.94 51.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -176.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -78.13 138.62 38.81 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -135.99 161.63 35.12 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.842 1.657 . . . . 0.0 107.489 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.3 m -126.64 113.42 16.7 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 120.755 -1.216 . . . . 0.0 108.473 -177.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 4.2 m -156.12 169.85 23.54 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 127.553 2.341 . . . . 0.0 105.981 175.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 100.42 144.47 15.86 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 103.98 -3.648 . . . . 0.0 103.98 -175.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -124.43 122.18 36.95 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 -175.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.53 176.1 10.07 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 126.167 1.787 . . . . 0.0 108.345 175.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 95.7 mtp -71.68 4.08 3.5 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.277 1.031 . . . . 0.0 111.829 175.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.5 m -146.4 175.67 10.37 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 119.856 -1.777 . . . . 0.0 108.823 -176.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.69 154.09 30.46 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.983 0.897 . . . . 0.0 108.984 -178.156 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -127.73 163.33 24.55 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.519 1.528 . . . . 0.0 108.297 -178.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.6 t -146.35 142.64 28.44 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -138.71 170.2 16.43 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.919 1.688 . . . . 0.0 106.966 176.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -146.38 129.77 16.77 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.8 133.93 49.74 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -99.88 113.21 25.6 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 102.296 -3.224 . . . . 0.0 102.296 175.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.2 mp -91.4 141.31 14.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -123.59 123.21 40.08 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 101.762 -3.422 . . . . 0.0 101.762 175.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.7 t-105 -95.44 123.41 38.96 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 103.84 -2.652 . . . . 0.0 103.84 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.677 HD11 HG21 ' A' ' 97' ' ' THR . 19.8 mt -142.41 85.7 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 102.384 -3.191 . . . . 0.0 102.384 175.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.69 144.48 7.19 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 176.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.9 tm-20 -57.28 -18.56 17.11 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -83.85 -36.23 23.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 124.778 1.231 . . . . 0.0 112.426 -177.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -73.87 123.32 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 107.216 -1.401 . . . . 0.0 107.216 175.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 5.1 t -146.22 176.38 9.79 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.717 1.207 . . . . 0.0 108.942 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 84.47 -148.7 24.13 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.743 -0.598 . . . . 0.0 111.719 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -54.75 -29.9 55.05 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.46 1.104 . . . . 0.0 109.309 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -57.64 -43.57 84.98 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.058 -1.026 . . . . 0.0 110.82 175.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -43.54 74.8 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 175.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.05 -31.07 64.8 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.237 0.615 . . . . 0.0 112.115 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -59.4 -61.42 2.64 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 175.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.677 HG21 HD11 ' A' ' 85' ' ' ILE . 96.4 m -53.75 -40.01 65.8 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 122.656 0.383 . . . . 0.0 110.676 178.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.68 -22.25 61.62 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 123.592 0.615 . . . . 0.0 114.296 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 63.7 m -108.49 -8.1 15.62 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.104 1.361 . . . . 0.0 111.902 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -103.27 -24.74 13.51 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.767 1.227 . . . . 0.0 112.189 -175.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -55.62 -33.27 63.84 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 120.294 1.406 . . . . 0.0 111.383 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.2 t -59.36 -36.84 76.48 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.95 0.795 . . . . 0.0 112.075 175.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.431 ' HB3' HG22 ' A' ' 8' ' ' ILE . 12.7 mt -63.19 -63.84 1.08 Allowed 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 125.14 1.376 . . . . 0.0 109.319 -175.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -32.88 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-O 117.73 -1.128 . . . . 0.0 109.793 175.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.81 -37.41 86.62 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.75 1.614 . . . . 0.0 110.418 176.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.33 -24.77 65.3 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.308 0.958 . . . . 0.0 111.374 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 58.9 t -84.98 -54.02 9.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 175.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 72.1 t -71.85 14.01 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 130.269 3.428 . . . . 0.0 113.35 -175.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -50.25 -26.55 4.84 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 119.759 -1.838 . . . . 0.0 115.119 -175.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -92.32 52.08 1.88 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.241 1.017 . . . . 0.0 109.646 175.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.08 176.46 5.12 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.72 2.008 . . . . 0.0 110.705 177.133 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.8 -67.07 0.86 Allowed 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -165.09 176.17 8.76 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 128.495 2.718 . . . . 0.0 108.734 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -113.61 173.61 6.33 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 124.663 1.185 . . . . 0.0 111.685 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -147.54 155.99 42.4 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 105.156 -2.164 . . . . 0.0 105.156 -175.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 14.3 t -129.08 124.9 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 175.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mt -125.19 141.29 45.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 125.804 1.641 . . . . 0.0 107.867 -175.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 10.2 p -131.07 -9.81 3.81 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -175.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -145.97 160.64 41.57 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 118.447 0.567 . . . . 0.0 110.771 -175.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -53.38 -42.86 67.35 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.254 1.421 . . . . 0.0 111.204 176.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -67.47 -37.15 82.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.636 0.653 . . . . 0.0 111.989 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -71.77 -23.66 61.63 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.896 0.879 . . . . 0.0 110.545 177.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -80.77 -24.56 38.55 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.095 -1.003 . . . . 0.0 113.38 -176.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -61.5 123.61 18.34 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.904 0.774 . . . . 0.0 111.492 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -54.66 -23.61 18.1 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -56.42 -49.99 72.95 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 -175.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -88.94 -25.65 21.96 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.873 177.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 34.5 mt -52.7 -43.41 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -55.0 -50.48 68.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 119.083 -0.484 . . . . 0.0 111.048 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.5 t -64.08 -43.32 95.77 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-O 118.803 -0.618 . . . . 0.0 110.604 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -53.65 -52.81 58.75 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.543 1.137 . . . . 0.0 109.372 177.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.12 -29.29 70.13 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.008 0.923 . . . . 0.0 112.159 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -72.29 -44.27 63.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.393 1.077 . . . . 0.0 110.018 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 45.8 mmtt -60.53 -53.53 56.46 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 176.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.19 -9.88 12.98 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.186 1.394 . . . . 0.0 113.103 178.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -72.06 -18.68 77.98 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 119.322 0.964 . . . . 0.0 111.823 175.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -74.96 145.93 34.34 Favored Glycine 0 C--N 1.338 0.665 0 N-CA-C 109.193 -1.563 . . . . 0.0 109.193 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -73.49 146.82 44.62 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 118.309 1.054 . . . . 0.0 110.036 176.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -150.15 124.37 9.48 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 175.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -147.42 99.73 3.17 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 123.721 0.809 . . . . 0.0 109.371 -175.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -129.86 141.88 50.75 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.621 1.168 . . . . 0.0 108.783 175.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -144.09 120.78 11.17 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 126.133 1.773 . . . . 0.0 107.245 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -137.03 160.15 39.78 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 126.178 1.791 . . . . 0.0 108.593 177.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 41.81 44.94 2.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.573 2.349 . . . . 0.0 110.68 -175.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 117.715 -1.136 . . . . 0.0 109.513 -179.376 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.063 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 28.1 mm -137.63 -73.06 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-N 118.718 1.259 . . . . 0.0 109.292 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -77.82 72.85 4.39 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.286 0.948 . . . . 0.0 110.43 -175.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 45.0 mtm -147.2 176.48 9.94 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 128.326 2.65 . . . . 0.0 107.513 175.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.27 59.64 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 127.992 2.517 . . . . 0.0 114.137 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.3 m -64.05 157.33 25.54 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.51 2.324 . . . . 0.0 108.409 176.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -131.74 175.44 9.19 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.266 1.026 . . . . 0.0 110.119 -176.099 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.647 HG22 HG12 ' A' ' 39' ' ' ILE . 0.1 OUTLIER -121.42 151.98 24.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 O-C-N 121.541 -0.725 . . . . 0.0 110.247 176.017 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -87.19 65.71 8.95 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 104.87 -2.271 . . . . 0.0 104.87 175.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.93 -39.93 63.22 Favored 'General case' 0 CA--C 1.512 -0.482 0 C-N-CA 124.395 1.078 . . . . 0.0 111.931 -175.232 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -67.84 -35.23 78.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 118.753 0.706 . . . . 0.0 111.771 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.29 -50.26 16.64 Favored 'General case' 0 CA--C 1.523 -0.084 0 CA-C-N 119.727 1.149 . . . . 0.0 109.882 175.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.0 m -62.36 -27.79 69.31 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.906 -0.496 . . . . 0.0 110.996 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -58.52 -41.61 85.84 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 117.72 -1.133 . . . . 0.0 109.518 175.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.54 -54.32 38.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 123.779 0.674 . . . . 0.0 110.116 -175.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.08 75.15 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -52.94 -40.66 63.82 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 119.015 -0.517 . . . . 0.0 109.618 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -58.43 -48.77 79.62 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 123.448 0.699 . . . . 0.0 111.013 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mp -54.33 -56.36 19.25 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 124.029 0.932 . . . . 0.0 110.856 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.0 -30.08 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 122.146 -0.346 . . . . 0.0 111.089 -176.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.0 ttp85 -76.89 -25.05 52.59 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.382 1.073 . . . . 0.0 112.273 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -83.67 124.35 30.75 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 126.185 1.794 . . . . 0.0 112.313 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -64.83 -22.27 66.95 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 123.924 0.89 . . . . 0.0 112.869 175.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.76 -14.35 75.77 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-N 119.169 0.895 . . . . 0.0 112.854 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.5 t -70.13 146.03 51.13 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.898 1.349 . . . . 0.0 111.942 -175.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.03 -29.58 23.34 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 175.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.8 t -74.86 129.95 36.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 176.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.87 -24.02 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 O-C-N 124.296 0.997 . . . . 0.0 110.235 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -125.45 144.65 50.43 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 124.349 1.06 . . . . 0.0 109.275 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.9 t -137.53 162.78 32.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 C-N-CA 128.501 2.72 . . . . 0.0 107.631 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 51.0 p -132.06 162.22 31.31 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.601 1.161 . . . . 0.0 108.174 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -133.92 143.82 48.46 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -120.64 176.67 5.4 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.405 ' CE2' HD12 ' A' ' 39' ' ' ILE . 23.9 m-85 -120.33 141.01 50.42 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.479 0.712 . . . . 0.0 109.118 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -151.09 123.83 8.56 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.066 0.946 . . . . 0.0 109.285 175.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 54.19 -125.9 34.91 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.1 p -98.34 30.05 3.34 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 124.516 1.127 . . . . 0.0 111.945 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.6 t -151.84 165.4 34.62 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 175.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.647 HG12 HG22 ' A' ' 8' ' ' ILE . 12.2 mm -89.41 135.03 27.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 103.743 -2.688 . . . . 0.0 103.743 175.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.437 ' HB ' ' HD2' ' A' ' 41' ' ' PRO . 6.0 m -122.34 167.19 14.66 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 124.687 1.195 . . . . 0.0 109.297 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.437 ' HD2' ' HB ' ' A' ' 40' ' ' VAL . 57.0 Cg_endo -66.06 170.08 12.4 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 CA-C-N 120.506 1.216 . . . . 0.0 111.302 176.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -135.41 -168.11 11.5 Favored Glycine 0 CA--C 1.523 0.559 0 C-N-CA 125.614 1.578 . . . . 0.0 109.85 176.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -74.69 170.46 15.78 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 124.566 1.146 . . . . 0.0 109.731 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -146.46 168.47 21.12 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 124.949 1.3 . . . . 0.0 110.206 -176.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.33 -178.03 46.67 Favored Glycine 0 CA--C 1.521 0.41 0 CA-C-O 121.968 0.76 . . . . 0.0 112.772 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.76 -24.11 7.31 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.552 1.541 . . . . 0.0 110.776 176.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -109.12 123.21 48.83 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.4 ' CD1' ' HG3' ' A' ' 125' ' ' GLU . 33.3 t80 -83.1 -15.88 49.08 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.368 -175.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -54.11 -34.54 60.52 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 121.468 1.94 . . . . 0.0 111.666 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -66.16 -32.98 74.75 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 123.429 0.692 . . . . 0.0 112.123 175.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.95 -45.59 67.79 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.292 1.437 . . . . 0.0 109.622 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 mp -63.46 -33.12 59.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.507 -0.745 . . . . 0.0 110.958 -178.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -80.21 -26.45 39.15 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.961 1.304 . . . . 0.0 110.269 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -71.98 -39.02 69.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.451 1.5 . . . . 0.0 110.278 176.026 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 67.4 m -50.49 114.36 1.11 Allowed 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.953 1.301 . . . . 0.0 111.246 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.619 ' OG1' HG22 ' A' ' 59' ' ' VAL . 2.7 p -84.26 143.24 29.69 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 127.995 2.518 . . . . 0.0 110.635 -176.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -50.54 -59.74 3.72 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 126.172 1.789 . . . . 0.0 112.94 -177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -106.67 -33.79 7.51 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 125.496 1.518 . . . . 0.0 113.927 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.619 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -72.31 155.11 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 C-N-CA 118.086 -1.446 . . . . 0.0 109.429 -175.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.7 151.44 22.99 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -178.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.3 tp -147.48 157.35 43.53 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 124.424 1.09 . . . . 0.0 108.478 -175.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -128.84 142.77 50.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -137.46 124.08 21.01 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 123.838 0.855 . . . . 0.0 112.001 -176.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -95.85 123.57 39.49 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 105.27 -2.122 . . . . 0.0 105.27 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.9 t -136.53 143.57 35.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 123.365 0.666 . . . . 0.0 109.395 -175.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.52 136.2 33.21 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -136.27 170.76 15.51 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.755 2.022 . . . . 0.0 107.81 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m -132.99 127.79 34.93 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.639 1.576 . . . . 0.0 110.116 176.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.9 m -156.42 152.42 27.48 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 175.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.77 131.58 1.36 Allowed Glycine 0 C--N 1.332 0.334 0 N-CA-C 103.896 -3.682 . . . . 0.0 103.896 -175.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -137.29 149.88 47.4 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -174.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.28 -173.03 4.07 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 131.314 3.846 . . . . 0.0 105.128 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 27.9 mmt -62.88 -6.37 3.71 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 120.318 1.417 . . . . 0.0 110.969 175.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.5 m -125.63 143.23 51.12 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 130.028 3.331 . . . . 0.0 105.979 175.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -67.79 154.57 41.23 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 87.9 mtt-85 -111.8 165.68 11.85 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.7 t -133.51 135.99 44.78 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.7 mtpp -139.87 123.97 17.75 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 125.933 1.693 . . . . 0.0 107.791 -175.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.57 134.76 33.62 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 176.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -108.01 127.9 54.18 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.542 1.537 . . . . 0.0 107.169 176.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -103.99 113.27 26.69 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 175.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.8 mp -93.74 135.46 28.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 -177.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -117.38 123.47 46.52 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 106.071 -1.825 . . . . 0.0 106.071 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 52.1 t-105 -100.96 123.41 45.11 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 105.745 -1.946 . . . . 0.0 105.745 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.7 mm -141.56 89.84 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 101.001 -3.703 . . . . 0.0 101.001 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.48 145.0 8.25 Favored Glycine 0 C--N 1.339 0.726 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.44 -5.44 7.72 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.103 0.951 . . . . 0.0 113.134 -175.441 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -83.3 -35.5 25.2 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 124.799 1.24 . . . . 0.0 111.771 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.2 p -82.71 132.78 30.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 120.074 1.307 . . . . 0.0 109.656 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.5 t -146.22 176.56 9.66 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 126.674 1.99 . . . . 0.0 108.589 -175.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 81.29 -155.48 36.2 Favored Glycine 0 CA--C 1.519 0.311 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.49 -29.56 59.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 122.963 0.505 . . . . 0.0 110.959 -177.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 -57.22 -39.41 75.42 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.872 1.669 . . . . 0.0 111.334 176.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -71.45 -53.05 15.28 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 175.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.65 -23.39 6.49 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 117.225 -1.369 . . . . 0.0 113.527 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -48.82 -44.11 38.98 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 120.678 1.581 . . . . 0.0 109.184 175.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.2 m -56.29 -27.78 56.57 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.983 1.713 . . . . 0.0 111.918 178.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -75.95 -25.92 65.75 Favored Glycine 0 CA--C 1.529 0.943 0 O-C-N 120.809 -1.182 . . . . 0.0 112.449 175.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 54.6 m -93.32 -20.18 20.64 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.806 1.242 . . . . 0.0 110.136 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -104.14 -23.97 13.22 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -174.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -58.14 -33.04 68.75 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 122.353 2.342 . . . . 0.0 111.225 177.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.9 t -68.53 -27.49 66.15 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.663 1.12 . . . . 0.0 112.25 175.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.42 ' O ' HG21 ' A' ' 8' ' ' ILE . 15.5 mt -67.85 -62.16 1.54 Allowed 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.125 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.301 0.8 OUTLIER -57.87 -24.69 23.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.313 175.471 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -63.79 -33.19 75.11 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.814 1.643 . . . . 0.0 109.57 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -62.34 -24.26 67.23 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 120.665 1.575 . . . . 0.0 111.816 175.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 92.2 t -86.01 -63.4 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 41.5 t -73.13 26.16 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 131.64 3.976 . . . . 0.0 112.71 -175.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -54.25 -26.0 26.41 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 119.751 -1.843 . . . . 0.0 111.643 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -97.37 88.84 4.52 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 175.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -153.08 176.44 11.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.436 0.636 . . . . 0.0 111.003 176.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -108.61 -66.03 1.08 Allowed 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.432 1.093 . . . . 0.0 109.982 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.98 174.88 11.11 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 119.044 0.838 . . . . 0.0 109.464 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . 0.254 0.0 OUTLIER -118.84 169.62 9.7 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.625 1.17 . . . . 0.0 109.599 175.495 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.415 ' CD1' HD11 ' A' ' 117' ' ' ILE . 0.5 OUTLIER -144.15 149.15 36.02 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 104.205 -2.517 . . . . 0.0 104.205 -175.662 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.31 123.47 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.415 HD11 ' CD1' ' A' ' 115' ' ' PHE . 2.8 mp -130.87 145.22 35.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 125.286 1.434 . . . . 0.0 107.889 -176.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 p -136.65 -9.46 1.88 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.741 1.216 . . . . 0.0 113.76 -176.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -115.42 124.46 51.22 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 176.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 17.8 ttp-105 -59.49 -36.68 76.52 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.92 0.888 . . . . 0.0 111.721 -177.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -35.96 77.05 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 120.254 1.388 . . . . 0.0 111.422 177.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.88 -41.52 91.48 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 123.744 0.653 . . . . 0.0 110.324 -175.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -43.61 -23.11 0.06 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 131.456 3.903 . . . . 0.0 115.425 -176.158 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -43.93 141.41 1.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.014 1.726 . . . . 0.0 111.222 175.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.4 ' HG3' ' CD1' ' A' ' 48' ' ' TYR . 7.2 mt-10 -61.42 -21.84 64.46 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -175.49 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.485 ' HA ' ' HE3' ' A' ' 129' ' ' LYS 0.276 7.9 t70 -65.81 -43.57 88.27 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 121.541 1.973 . . . . 0.0 113.448 -175.168 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.16 -26.39 60.28 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 113.84 -3.144 . . . . 0.0 106.44 -176.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 58.5 mt -60.64 -49.54 84.04 Favored 'Isoleucine or valine' 0 C--N 1.345 0.39 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 175.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.485 ' HE3' ' HA ' ' A' ' 126' ' ' ASP . 15.4 mtmt -56.26 -45.91 79.88 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.554 -0.716 . . . . 0.0 111.327 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -73.53 -38.17 65.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 119.403 1.002 . . . . 0.0 110.904 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -66.52 -43.73 84.42 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.51 1.524 . . . . 0.0 109.879 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.06 -36.69 82.39 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -67.2 -41.4 85.88 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 124.551 1.14 . . . . 0.0 111.429 175.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -62.02 -41.35 97.99 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 120.832 1.651 . . . . 0.0 109.135 175.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.27 -0.32 14.13 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.667 0.787 . . . . 0.0 112.212 175.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -82.21 64.91 4.17 Favored Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 107.882 -2.087 . . . . 0.0 107.882 175.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -53.29 148.26 15.23 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 108.368 -1.893 . . . . 0.0 108.368 175.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -53.96 94.48 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.916 1.286 . . . . 0.0 112.336 -175.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -129.75 60.78 1.58 Allowed 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 175.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -115.25 90.81 3.43 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 -178.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -145.71 153.61 41.17 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 128.558 2.743 . . . . 0.0 104.913 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.86 78.5 1.25 Allowed 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.203 1.401 . . . . 0.0 107.653 -176.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -75.59 70.72 2.45 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 176.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.9 m 62.9 56.06 1.92 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.738 1.615 . . . . 0.0 108.414 -175.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 . . . . . 0 C--O 1.251 1.171 0 C-N-CA 125.914 1.686 . . . . 0.0 106.646 178.589 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.57 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 5.4 mp -129.09 -104.69 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 N-CA-C 104.948 -2.241 . . . . 0.0 104.948 172.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 6.5 ttp85 -142.28 111.24 6.34 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 105.838 -1.912 . . . . 0.0 105.838 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 6.0 ttt -156.3 141.2 17.16 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 -177.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -115.92 83.74 1.99 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.162 0.985 . . . . 0.0 109.323 175.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 61.2 m -116.23 161.14 19.42 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 103.766 -2.679 . . . . 0.0 103.766 175.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.536 ' HG2' ' H ' ' A' ' 8' ' ' ILE . 38.6 tttt -132.26 -174.01 3.32 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 121.144 -0.973 . . . . 0.0 110.555 -175.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.536 ' H ' ' HG2' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -132.39 151.68 35.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 125.825 1.65 . . . . 0.0 108.298 175.647 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -103.2 86.32 2.66 Favored 'General case' 0 C--O 1.236 0.352 1 N-CA-C 98.488 -4.634 . . . . 0.0 98.488 174.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -55.13 -29.37 57.57 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 116.899 -1.524 . . . . 0.0 113.757 -175.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -74.33 -50.43 18.78 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 120.878 1.672 . . . . 0.0 110.222 -176.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.14 90.0 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.63 ' HB3' HG11 ' A' ' 107' ' ' VAL . 17.1 m -68.88 -41.95 77.63 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.526 -0.734 . . . . 0.0 112.117 175.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -57.06 -37.62 72.09 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 117.85 -1.071 . . . . 0.0 109.855 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.27 -35.6 69.96 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 119.005 0.82 . . . . 0.0 111.984 -176.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.59 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -78.43 -50.17 12.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 119.185 0.902 . . . . 0.0 111.274 175.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -49.47 -43.76 45.39 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.757 1.223 . . . . 0.0 110.13 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -64.77 -43.38 93.44 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 118.348 -0.834 . . . . 0.0 111.841 -177.344 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.79 -52.26 65.82 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 119.224 0.92 . . . . 0.0 111.385 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.458 ' CG2' HG23 ' A' ' 30' ' ' VAL . 93.8 t -60.35 -34.27 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 122.439 0.296 . . . . 0.0 110.216 -177.457 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.4 ttt-85 -72.56 -32.57 66.14 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 125.158 1.383 . . . . 0.0 113.124 176.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.22 149.3 50.54 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.957 1.303 . . . . 0.0 113.887 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.57 -23.21 34.57 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.781 1.233 . . . . 0.0 113.162 -177.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.77 -14.67 24.55 Favored Glycine 0 CA--C 1.527 0.807 0 CA-C-N 118.782 0.719 . . . . 0.0 112.538 -177.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -64.95 123.71 20.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 118.304 1.052 . . . . 0.0 109.214 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.07 -31.94 69.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.248 175.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 t -60.62 129.41 23.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 176.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.4 HD12 HG13 ' A' ' 65' ' ' VAL . 1.1 pp -114.69 -24.43 3.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 124.075 0.859 . . . . 0.0 110.603 178.601 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -129.68 137.84 50.84 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.646 1.112 . . . . 0.0 109.685 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.59 HG11 ' HB1' ' A' ' 16' ' ' ALA . 23.6 t -140.6 148.39 22.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 175.282 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 42.1 p -105.56 160.32 15.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.133 0.492 . . . . 0.0 111.324 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -129.25 123.08 31.03 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 104.347 -2.464 . . . . 0.0 104.347 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.0 mmtm -100.49 176.66 5.27 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 127.407 2.283 . . . . 0.0 105.921 177.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -115.82 153.62 31.15 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -137.74 152.96 49.75 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 128.991 2.916 . . . . 0.0 105.86 175.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 12.87 -80.33 0.0 OUTLIER Glycine 0 C--N 1.339 0.737 0 C-N-CA 128.038 2.732 . . . . 0.0 115.67 175.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.9 p -129.8 23.91 5.37 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.515 1.126 . . . . 0.0 113.569 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.0 t -151.21 171.63 17.1 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -176.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 12.3 mm -92.93 139.61 17.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 C-N-CA 125.898 1.679 . . . . 0.0 107.439 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.6 m -131.48 153.93 81.73 Favored Pre-proline 0 N--CA 1.472 0.628 0 C-N-CA 124.436 1.094 . . . . 0.0 111.387 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.33 153.71 50.78 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 121.736 1.624 . . . . 0.0 109.491 175.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.69 -142.62 6.97 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 125.484 1.516 . . . . 0.0 110.744 177.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -72.73 165.39 24.9 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.841 1.256 . . . . 0.0 109.755 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.456 ' HB3' HG13 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -145.08 165.1 29.21 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 125.772 1.629 . . . . 0.0 110.809 177.087 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.6 173.78 42.01 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-O 122.731 1.184 . . . . 0.0 112.962 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.46 7.47 5.34 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.484 2.314 . . . . 0.0 110.093 176.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -133.03 127.04 33.21 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 103.422 -2.807 . . . . 0.0 103.422 -175.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -84.43 -15.99 44.22 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 115.611 1.708 . . . . 0.0 115.611 -175.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -58.7 -40.19 82.92 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 121.959 2.163 . . . . 0.0 109.937 176.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -60.47 -30.58 69.77 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.767 0.427 . . . . 0.0 111.039 175.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -69.66 -36.12 75.77 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.539 -0.726 . . . . 0.0 109.652 178.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.5 mm -62.87 -46.95 95.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -63.6 -35.96 82.23 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.863 1.665 . . . . 0.0 111.926 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.0 -22.98 65.04 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 124.716 1.207 . . . . 0.0 114.049 177.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.9 m -64.23 113.99 3.94 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 119.377 0.989 . . . . 0.0 108.83 -178.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.254 2.3 p -103.36 154.85 18.96 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.495 1.118 . . . . 0.0 108.168 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -41.48 -74.76 0.03 OUTLIER 'General case' 0 C--O 1.234 0.272 0 N-CA-C 117.943 2.572 . . . . 0.0 117.943 -174.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -106.17 -36.14 6.99 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -175.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.7 m -53.75 132.16 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 123.235 0.614 . . . . 0.0 110.265 -175.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.51 123.11 46.3 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 -177.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 32.7 tp -122.42 176.11 6.07 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 127.023 2.129 . . . . 0.0 111.284 -174.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -136.48 151.76 49.81 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.49 0.716 . . . . 0.0 110.233 176.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -142.92 123.42 13.99 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.739 0.815 . . . . 0.0 111.295 175.508 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.42 ' CD1' HG13 ' A' ' 108' ' ' VAL . 40.2 t80 -88.41 123.88 33.4 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 104.65 -2.352 . . . . 0.0 104.65 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.407 HG21 HD13 ' A' ' 82' ' ' ILE . 44.4 t -134.28 140.54 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-N 118.103 0.41 . . . . 0.0 109.919 -175.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.9 tmm_? -85.42 117.84 24.59 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 175.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -112.23 123.45 50.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 108.696 -175.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.1 m -73.78 116.14 14.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 176.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 85.6 m -84.31 169.72 14.38 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 124.429 1.091 . . . . 0.0 110.564 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -56.2 130.36 49.3 Favored Glycine 0 C--N 1.34 0.798 0 N-CA-C 108.304 -1.918 . . . . 0.0 108.304 176.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.91 160.73 22.79 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 126.355 1.862 . . . . 0.0 113.302 -175.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.51 -173.62 4.25 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 130.221 3.408 . . . . 0.0 106.3 175.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -63.51 -5.87 4.35 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.414 -0.804 . . . . 0.0 112.371 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.1 m -135.74 158.27 44.81 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 127.599 2.359 . . . . 0.0 106.794 175.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -57.09 150.2 17.75 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 123.455 0.702 . . . . 0.0 109.703 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 75.2 mmt-85 -135.4 134.04 39.29 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 175.477 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.2 t -146.59 139.12 25.11 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 124.461 1.105 . . . . 0.0 108.316 -176.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -142.41 176.63 8.85 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.508 1.523 . . . . 0.0 107.214 177.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -131.52 124.35 29.91 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 -176.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -111.56 114.12 26.98 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 104.108 -2.553 . . . . 0.0 104.108 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.9 tt -82.88 113.15 20.3 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 105.361 -2.088 . . . . 0.0 105.361 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.561 HG23 HD12 ' A' ' 117' ' ' ILE . 3.1 mp -79.4 123.8 36.8 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 N-CA-C 105.458 -2.053 . . . . 0.0 105.458 175.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.8 m -106.4 123.11 47.57 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 101.242 -3.614 . . . . 0.0 101.242 175.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -95.49 124.06 39.34 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.475 HD11 HG21 ' A' ' 97' ' ' THR . 10.5 mm -133.94 81.92 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 N-CA-C 103.696 -2.705 . . . . 0.0 103.696 177.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -44.26 130.47 7.09 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 107.986 -2.046 . . . . 0.0 107.986 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -56.0 -10.64 0.84 Allowed 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -83.21 -28.17 29.45 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 117.576 -1.202 . . . . 0.0 110.804 177.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.7 p -71.03 133.53 31.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 120.744 1.611 . . . . 0.0 109.064 -177.342 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 42.5 t -146.31 176.18 9.96 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.84 1.656 . . . . 0.0 107.011 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.65 -157.2 53.52 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 95' ' ' ALA . 5.1 tt -60.23 -30.98 69.76 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-O 118.049 -0.977 . . . . 0.0 112.047 -175.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -58.17 -45.15 87.98 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 120.304 1.411 . . . . 0.0 110.109 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -36.25 76.98 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 175.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.421 ' HB3' ' HA ' ' A' ' 92' ' ' LEU . . . -62.32 -23.57 66.82 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.084 -0.96 . . . . 0.0 112.573 177.026 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -56.19 -54.35 46.25 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-N 119.919 1.236 . . . . 0.0 108.861 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.475 HG21 HD11 ' A' ' 85' ' ' ILE . 54.0 m -52.28 -40.41 61.72 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 175.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -55.4 -24.78 39.22 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-O 118.864 -0.964 . . . . 0.0 115.415 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.2 m -115.7 -6.64 12.15 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.184 1.492 . . . . 0.0 112.201 176.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -103.91 -23.46 13.36 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 125.733 1.613 . . . . 0.0 111.974 -175.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.4 mtmp? -53.31 -29.88 36.0 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.44 1.473 . . . . 0.0 111.981 176.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -63.69 -36.83 85.15 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.942 0.897 . . . . 0.0 111.137 176.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 18.1 mt -64.81 -62.27 1.67 Allowed 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 125.363 1.465 . . . . 0.0 108.723 -176.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.409 ' H ' HG12 ' A' ' 104' ' ' VAL 0.264 0.9 OUTLIER -61.14 -28.1 43.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.472 176.354 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 34.1 tttm -62.14 -40.56 96.35 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 121.246 1.839 . . . . 0.0 109.43 175.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -57.51 -24.51 56.33 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.687 1.13 . . . . 0.0 112.253 177.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.63 HG11 ' HB3' ' A' ' 13' ' ' CYS . 55.3 t -84.62 -63.24 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 175.268 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.42 HG13 ' CD1' ' A' ' 64' ' ' PHE . 87.1 t -65.22 26.46 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.873 1 C-N-CA 132.289 4.236 . . . . 0.0 113.644 -175.612 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -54.12 -27.05 30.81 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 119.314 -2.116 . . . . 0.0 114.035 -175.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -90.78 79.86 5.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 175.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -148.58 176.32 10.43 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 122.375 0.27 . . . . 0.0 110.591 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.42 -59.29 2.02 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.982 0.913 . . . . 0.0 111.04 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -147.54 171.94 14.77 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 125.335 1.454 . . . . 0.0 110.248 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -123.51 134.02 53.93 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -107.1 144.37 33.89 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 104.998 -2.223 . . . . 0.0 104.998 -174.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.6 t -104.0 123.54 57.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 175.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.561 HD12 HG23 ' A' ' 82' ' ' ILE . 98.9 mt -129.08 137.25 57.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 106.225 -1.768 . . . . 0.0 106.225 -175.4 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.5 p -142.69 -4.01 0.98 Allowed 'General case' 0 C--O 1.239 0.528 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -175.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -146.82 152.13 38.24 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.103 1.361 . . . . 0.0 109.229 -175.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -60.11 -36.17 76.85 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 117.313 -1.327 . . . . 0.0 112.361 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -63.08 -37.45 87.27 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 121.273 1.851 . . . . 0.0 110.584 176.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -68.13 -23.17 64.86 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.108 2.163 . . . . 0.0 111.485 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -84.82 -23.37 29.13 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.256 1.822 . . . . 0.0 113.349 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -59.35 125.76 24.9 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 120.102 1.319 . . . . 0.0 112.12 -175.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -56.9 -27.93 61.33 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.254 -0.904 . . . . 0.0 113.316 176.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -54.59 -60.68 3.03 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 123.575 0.75 . . . . 0.0 111.249 -177.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -80.56 -24.22 39.39 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 117.769 -1.572 . . . . 0.0 109.017 -175.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 27.8 mt -54.47 -47.34 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 175.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -54.09 -49.89 68.07 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 118.78 0.718 . . . . 0.0 112.038 175.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.8 t -71.91 -29.16 64.02 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.598 0.635 . . . . 0.0 111.661 -176.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -72.11 -47.14 53.43 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 119.301 0.955 . . . . 0.0 109.165 176.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 78.0 mt -60.17 -36.95 78.73 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 175.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.0 mtmt -61.68 -53.21 59.21 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 175.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? -57.05 -45.77 82.96 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.976 1.262 . . . . 0.0 111.209 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.68 -3.67 23.06 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 117.964 -1.017 . . . . 0.0 112.873 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -106.06 155.82 16.59 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 108.901 -1.68 . . . . 0.0 108.901 175.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 158.26 95.34 0.11 Allowed Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 107.658 -2.177 . . . . 0.0 107.658 -176.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -154.65 137.73 15.57 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 125.902 1.681 . . . . 0.0 107.606 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -69.52 117.91 11.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -114.32 100.47 8.36 Favored 'General case' 0 N--CA 1.438 -1.036 0 N-CA-C 100.971 -3.714 . . . . 0.0 100.971 175.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -63.39 156.73 25.08 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 125.112 1.365 . . . . 0.0 109.737 -175.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -132.2 94.81 3.53 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -178.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -143.73 129.23 19.05 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 101.411 -3.551 . . . . 0.0 101.411 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 63.85 31.86 13.74 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -175.177 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 . . . . . 0 C--O 1.244 0.801 1 C-N-CA 133.694 4.798 . . . . 0.0 103.572 -177.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.675 0 N-CA-C 111.161 -0.776 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.3 tt -87.8 150.87 3.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 166.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.52 64.63 1.65 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 122.101 0.953 . . . . 0.0 109.044 175.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 8.6 ttm -150.17 175.46 11.74 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 128.277 2.631 . . . . 0.0 105.564 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.53 144.57 56.89 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.541 1.064 . . . . 0.0 109.712 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.433 ' HB ' HD11 ' A' ' 103' ' ' LEU . 3.2 m -142.6 162.07 36.42 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.565 1.946 . . . . 0.0 106.621 -176.328 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.1 mtpt -131.62 -173.06 3.02 Favored 'General case' 0 CA--C 1.516 -0.328 0 O-C-N 121.316 -0.865 . . . . 0.0 111.303 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.13 148.38 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 C-N-CA 126.908 2.083 . . . . 0.0 105.654 175.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -88.31 74.05 8.74 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 101.9 -3.37 . . . . 0.0 101.9 175.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.85 -44.61 59.52 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 125.391 1.477 . . . . 0.0 112.875 -174.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -65.47 -49.34 69.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.083 0.856 . . . . 0.0 109.738 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.56 -34.39 74.11 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.322 -0.861 . . . . 0.0 112.0 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.5 m -74.78 -38.02 62.27 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.451 178.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.2 ttm180 -59.95 -27.25 66.65 Favored 'General case' 0 C--N 1.342 0.263 0 CA-C-O 116.975 -1.488 . . . . 0.0 111.17 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.06 -60.78 3.24 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 120.089 1.313 . . . . 0.0 110.465 176.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.445 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -62.38 -40.2 95.66 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.013 0.824 . . . . 0.0 111.073 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -58.77 -36.34 74.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.545 176.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -62.19 -44.96 95.41 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 119.925 1.239 . . . . 0.0 110.604 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.6 mp -56.68 -61.84 2.14 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 175.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.418 ' CG2' HG23 ' A' ' 30' ' ' VAL . 42.3 t -58.21 -34.44 49.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 O-C-N 121.742 -0.599 . . . . 0.0 111.498 -176.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.2 ttt-85 -67.71 -38.16 83.25 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 124.683 1.193 . . . . 0.0 111.213 175.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -66.56 137.07 56.5 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.891 0.876 . . . . 0.0 108.737 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.6 -11.06 57.8 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 125.279 1.432 . . . . 0.0 111.373 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -98.45 5.85 60.82 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.724 1.63 . . . . 0.0 112.225 175.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -85.63 141.55 29.72 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.248 1.524 . . . . 0.0 109.936 176.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -80.28 -29.0 38.24 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 175.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.9 t -73.62 125.03 32.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 175.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 pp -115.16 -24.49 3.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.816 1.246 . . . . 0.0 111.312 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.0 p-90 -125.38 145.21 50.15 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 119.224 0.92 . . . . 0.0 108.777 177.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.445 HG21 ' HB1' ' A' ' 16' ' ' ALA . 6.1 t -135.71 158.84 39.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 127.389 2.276 . . . . 0.0 106.151 176.135 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.449 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 42.0 p -119.15 154.5 33.19 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -126.69 123.58 37.85 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 176.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -107.04 176.72 5.08 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.171 2.188 . . . . 0.0 105.347 -175.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -116.94 155.53 28.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.485 0.659 . . . . 0.0 109.509 176.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -142.26 166.71 23.94 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 127.306 2.242 . . . . 0.0 105.906 175.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 14.07 -88.78 0.0 OUTLIER Glycine 0 CA--C 1.531 1.06 0 C-N-CA 128.385 2.898 . . . . 0.0 114.988 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 p -135.59 44.17 2.55 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 126.24 1.816 . . . . 0.0 109.312 175.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -155.1 174.29 15.39 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -176.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.3 mm -103.47 139.55 24.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 126.22 1.808 . . . . 0.0 106.968 175.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 16.6 m -135.66 160.54 67.25 Favored Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 124.98 1.312 . . . . 0.0 110.902 -178.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.87 149.11 53.15 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.525 2.15 . . . . 0.0 110.444 175.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -115.43 -145.95 8.72 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 126.706 2.098 . . . . 0.0 109.676 175.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -70.26 164.65 23.92 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -144.95 168.64 19.76 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.849 1.26 . . . . 0.0 108.49 175.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.81 174.92 46.91 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-O 121.88 0.711 . . . . 0.0 113.076 -177.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.64 -26.07 8.81 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.693 1.997 . . . . 0.0 110.691 176.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.02 129.18 55.45 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 -176.116 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -83.94 -8.5 59.15 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.404 1.261 . . . . 0.0 114.404 -174.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -58.56 -40.12 82.18 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 119.497 -2.002 . . . . 0.0 109.048 175.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -66.48 -22.54 66.19 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.597 -0.689 . . . . 0.0 111.601 176.106 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -66.61 -36.25 82.14 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-N 119.472 1.033 . . . . 0.0 109.801 176.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.9 mm -60.02 -39.7 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -72.7 -23.35 60.86 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.849 1.66 . . . . 0.0 113.313 175.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -73.97 -24.92 59.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 120.79 1.632 . . . . 0.0 110.036 175.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 79.9 m -71.56 159.37 34.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.598 -0.689 . . . . 0.0 109.432 176.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.629 ' OG1' HG22 ' A' ' 59' ' ' VAL . 16.7 p -132.63 -174.33 3.43 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.73 1.212 . . . . 0.0 112.644 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -77.01 -67.46 0.71 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.304 1.442 . . . . 0.0 108.448 175.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -106.45 -27.92 10.64 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 -175.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.629 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -65.58 167.77 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-N 121.997 2.18 . . . . 0.0 113.428 -175.162 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.2 124.87 45.74 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 175.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 56.2 tp -129.02 159.09 37.02 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 126.171 1.788 . . . . 0.0 107.962 -175.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -123.81 157.82 33.21 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.449 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -147.2 141.62 26.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 118.126 0.421 . . . . 0.0 111.319 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -106.54 123.58 48.31 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 176.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.2 t -135.62 138.15 48.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.834 0.826 . . . . 0.0 112.136 -175.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.5 ttm-85 -79.33 117.71 20.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 128.388 2.675 . . . . 0.0 107.15 175.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -136.18 167.75 20.69 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.7 m -128.67 130.44 47.22 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 120.8 -1.187 . . . . 0.0 107.804 175.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 m -154.84 121.51 5.42 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 175.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 75.29 121.72 0.12 Allowed Glycine 0 C--N 1.332 0.338 0 N-CA-C 107.162 -2.375 . . . . 0.0 107.162 -175.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . 0.275 6.1 m-20 -118.22 176.43 5.23 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.237 -0.981 . . . . 0.0 112.052 -175.099 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -144.49 -173.01 3.92 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 127.968 2.507 . . . . 0.0 107.317 -175.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 57.6 mtm -54.46 -5.85 0.09 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.923 0.889 . . . . 0.0 112.867 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 75.3 m -146.15 150.26 35.55 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 130.088 3.355 . . . . 0.0 103.76 175.141 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -64.37 158.5 23.47 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.661 -176.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.9 mtt180 -116.61 170.87 8.25 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.7 t -145.64 124.3 12.54 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 175.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -116.64 123.35 47.07 Favored 'General case' 0 CA--C 1.5 -0.979 0 C-N-CA 125.753 1.621 . . . . 0.0 107.361 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -86.31 131.46 34.21 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.713 -1.131 . . . . 0.0 108.683 -178.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.68 122.19 45.56 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -95.21 113.22 24.88 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 101.029 -3.693 . . . . 0.0 101.029 174.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -97.41 143.17 13.05 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 -176.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.7 m -126.18 123.5 38.37 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 175.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.3 t-105 -100.85 128.09 47.03 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 104.021 -2.585 . . . . 0.0 104.021 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.426 HD11 HG21 ' A' ' 97' ' ' THR . 7.5 mt -132.27 103.03 6.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 104.27 -2.492 . . . . 0.0 104.27 176.134 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.43 ' O ' HG12 ' A' ' 89' ' ' VAL . . . -48.7 138.09 15.18 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 176.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -66.62 -7.22 18.93 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.747 -1.443 . . . . 0.0 111.953 -176.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -85.45 -34.78 21.58 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 117.188 -1.387 . . . . 0.0 113.072 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.43 HG12 ' O ' ' A' ' 86' ' ' GLY . 3.2 p -64.39 124.1 18.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 120.941 1.701 . . . . 0.0 109.863 -175.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.8 t -65.82 162.13 19.5 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 122.616 1.198 . . . . 0.0 113.262 -175.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.02 -30.07 72.55 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 125.32 1.438 . . . . 0.0 113.715 -176.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.7 -46.95 87.5 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 118.478 1.139 . . . . 0.0 108.355 175.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -67.48 -41.96 83.71 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 123.171 0.588 . . . . 0.0 109.526 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -58.74 -24.95 62.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.739 0.7 . . . . 0.0 110.408 175.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.97 -39.17 93.87 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.061 -1.024 . . . . 0.0 110.531 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.65 -41.53 77.36 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 118.979 0.809 . . . . 0.0 108.849 176.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.426 HG21 HD11 ' A' ' 85' ' ' ILE . 3.4 m -59.1 -30.25 67.97 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.636 -176.281 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -70.88 -26.38 74.08 Favored Glycine 0 CA--C 1.532 1.128 0 CA-C-N 119.739 1.154 . . . . 0.0 112.448 175.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 33.5 m -89.48 -10.92 44.54 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.425 1.49 . . . . 0.0 109.974 175.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -103.46 -27.82 12.16 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.422 -0.799 . . . . 0.0 111.375 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -53.5 -51.94 61.18 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 119.767 1.167 . . . . 0.0 109.745 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -58.67 -34.62 71.46 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 123.455 0.702 . . . . 0.0 110.88 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.433 HD11 ' HB ' ' A' ' 6' ' ' THR . 14.8 mt -64.09 -62.39 1.66 Allowed 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 124.014 0.926 . . . . 0.0 110.074 178.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.253 0.9 OUTLIER -60.32 -25.72 34.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 118.481 -1.288 . . . . 0.0 110.224 176.503 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -67.92 -26.41 65.96 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 120.534 1.515 . . . . 0.0 109.729 175.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.68 -25.98 68.45 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.957 1.708 . . . . 0.0 110.729 175.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 79.0 t -86.16 -58.01 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 175.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 60.7 t -73.4 26.32 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 130.358 3.463 . . . . 0.0 111.695 -175.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.43 -26.19 64.97 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 119.814 -1.804 . . . . 0.0 111.261 -176.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -91.94 70.91 5.55 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 175.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.13 175.94 8.94 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.044 0.449 . . . . 0.0 111.001 176.181 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.85 -66.33 0.94 Allowed 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 108.696 -0.854 . . . . 0.0 108.696 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.97 175.08 13.44 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 128.343 2.657 . . . . 0.0 107.233 175.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -100.52 178.5 4.71 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 124.509 1.124 . . . . 0.0 112.692 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -143.43 144.54 32.07 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 103.712 -2.699 . . . . 0.0 103.712 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 57.5 t -123.22 131.12 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 175.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -129.64 147.99 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 126.551 1.94 . . . . 0.0 109.335 -175.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.3 p -146.02 9.42 1.13 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.507 1.123 . . . . 0.0 113.08 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -142.51 147.11 35.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -178.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -62.59 -24.22 67.45 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 119.777 1.172 . . . . 0.0 110.213 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -68.34 -55.05 13.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 175.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -56.73 -23.48 42.84 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.706 1.602 . . . . 0.0 111.073 175.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -79.68 -22.84 42.96 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.491 1.916 . . . . 0.0 113.482 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -60.22 124.77 21.29 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 119.488 1.04 . . . . 0.0 112.667 -177.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.406 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 11.9 mm-40 -58.27 -26.71 63.29 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 176.079 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -48.71 -66.32 0.42 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.181 1.792 . . . . 0.0 111.182 177.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -78.19 -21.76 49.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 117.077 -1.849 . . . . 0.0 108.768 -176.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.406 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 72.6 mt -55.13 -43.02 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 120.03 1.286 . . . . 0.0 107.793 176.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -54.18 -54.07 44.76 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 119.709 1.14 . . . . 0.0 111.393 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 47.5 t -67.19 -36.28 81.42 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.785 0.721 . . . . 0.0 111.103 -177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -61.7 -48.86 78.85 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.048 1.339 . . . . 0.0 109.402 176.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.68 -36.42 83.78 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.284 177.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -61.54 -55.55 29.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 175.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -56.01 -52.2 65.05 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 127.333 2.253 . . . . 0.0 111.5 -178.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.57 -25.74 67.55 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 121.393 -0.817 . . . . 0.0 111.798 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -84.84 -37.86 9.93 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 125.059 1.314 . . . . 0.0 113.396 -176.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -169.28 178.69 42.31 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-N 119.034 1.417 . . . . 0.0 111.436 -176.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.09 119.14 8.34 Favored 'General case' 0 CA--C 1.527 0.086 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -104.44 105.17 15.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -119.57 103.89 9.81 Favored 'General case' 0 N--CA 1.445 -0.681 1 N-CA-C 99.252 -4.351 . . . . 0.0 99.252 175.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -117.52 108.37 15.42 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 103.016 -2.957 . . . . 0.0 103.016 -175.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -131.71 136.66 47.81 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 126.154 1.782 . . . . 0.0 110.26 -175.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -78.22 25.38 0.23 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.458 2.303 . . . . 0.0 111.634 -178.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.2 m 85.83 56.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 128.428 2.691 . . . . 0.0 105.482 -174.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 . . . . . 0 C--O 1.246 0.893 0 C-N-CA 129.463 3.105 . . . . 0.0 104.549 -177.096 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.911 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.0 pt -134.55 -178.4 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 117.929 0.865 . . . . 0.0 110.246 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.27 135.98 56.74 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.43 166.15 34.25 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 127.223 2.209 . . . . 0.0 107.026 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -125.43 43.85 2.96 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 123.203 1.478 . . . . 0.0 110.043 175.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.7 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.4 m -96.27 171.24 8.71 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 127.463 2.305 . . . . 0.0 105.597 175.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.4 tttp -138.85 -170.95 2.97 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 120.787 -1.196 . . . . 0.0 111.268 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -140.2 151.36 21.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 124.342 1.057 . . . . 0.0 111.193 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -95.44 79.05 3.42 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 101.37 -3.567 . . . . 0.0 101.37 174.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -58.63 -33.08 69.64 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 116.569 -1.681 . . . . 0.0 112.188 -175.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -73.54 -54.32 8.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 119.283 0.947 . . . . 0.0 109.199 -176.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.67 -35.5 76.4 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 119.529 -0.272 . . . . 0.0 111.011 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.46 ' HB3' HG11 ' A' ' 107' ' ' VAL . 77.6 m -76.74 -32.3 57.68 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 117.811 -1.09 . . . . 0.0 110.819 175.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.78 -37.96 77.46 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 116.326 -1.797 . . . . 0.0 108.621 177.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.7 -61.62 2.19 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 119.521 1.055 . . . . 0.0 108.966 -177.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.461 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -68.12 -33.82 75.22 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.612 -0.68 . . . . 0.0 111.236 -176.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -59.32 -38.59 80.66 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.417 0.687 . . . . 0.0 110.239 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -66.06 -45.06 82.67 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 124.636 1.175 . . . . 0.0 109.04 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -54.69 -57.52 11.17 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 118.716 0.689 . . . . 0.0 109.267 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.6 t -61.07 -24.07 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 123.085 0.554 . . . . 0.0 112.335 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 -45.03 15.52 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 121.177 -0.952 . . . . 0.0 109.474 175.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -51.53 123.33 9.64 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 126.66 1.984 . . . . 0.0 110.943 -175.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -73.41 -9.87 59.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.489 -176.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.46 -8.09 50.24 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-O 118.914 -0.937 . . . . 0.0 112.576 175.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.6 t -68.39 148.03 51.25 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 118.744 1.272 . . . . 0.0 111.176 -175.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.13 -36.03 19.82 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.051 -1.432 . . . . 0.0 107.185 174.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.7 t -68.91 123.89 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.91 -24.46 3.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 124.392 1.077 . . . . 0.0 110.642 177.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -121.59 142.45 50.09 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.866 1.266 . . . . 0.0 108.179 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.461 HG21 ' HB1' ' A' ' 16' ' ' ALA . 7.3 t -137.98 160.19 33.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 126.606 1.962 . . . . 0.0 106.652 176.258 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 76.9 p -126.75 156.87 40.5 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 175.49 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -129.83 130.94 45.92 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.0 mmmt -103.8 176.1 5.26 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -123.88 139.79 53.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 176.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -131.54 123.3 27.69 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 175.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 47.31 -100.85 0.03 OUTLIER Glycine 0 CA--C 1.525 0.691 0 C-N-CA 124.606 1.098 . . . . 0.0 112.105 -176.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.3 p -120.23 42.72 2.89 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.617 1.167 . . . . 0.0 111.91 177.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.2 t -152.83 160.69 43.1 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.799 1.181 . . . . 0.0 111.4 175.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 21.3 mm -90.79 136.33 24.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.406 ' HB ' ' HD2' ' A' ' 41' ' ' PRO . 3.2 m -131.63 163.58 48.75 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 124.493 1.117 . . . . 0.0 109.976 178.471 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.406 ' HD2' ' HB ' ' A' ' 40' ' ' VAL . 73.0 Cg_endo -69.97 164.63 34.05 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.017 1.811 . . . . 0.0 111.242 175.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.1 -146.92 5.79 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 126.312 1.911 . . . . 0.0 108.856 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.81 161.12 26.89 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.878 1.271 . . . . 0.0 110.852 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.27 153.78 36.75 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.307 1.843 . . . . 0.0 110.266 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 174.5 -172.28 45.26 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-N 119.209 0.913 . . . . 0.0 113.279 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.69 -20.47 10.09 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 126.28 1.832 . . . . 0.0 113.002 -176.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -109.18 123.09 48.66 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 -176.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -82.35 -6.62 59.38 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.257 0.623 . . . . 0.0 112.49 -175.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -57.31 -29.29 63.8 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 120.83 -1.169 . . . . 0.0 112.7 177.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -74.6 -36.2 62.97 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.201 1.0 . . . . 0.0 111.239 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -56.76 -40.98 76.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 126.837 2.055 . . . . 0.0 109.087 -176.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.8 mm -55.57 -44.04 74.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 124.043 0.937 . . . . 0.0 108.583 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -85.43 -27.77 25.53 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.229 1.012 . . . . 0.0 111.988 -178.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -63.56 -27.26 69.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 118.323 -0.846 . . . . 0.0 111.259 176.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 75.4 m -60.8 120.45 10.14 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.252 2.1 p -83.96 158.94 21.37 Favored 'General case' 0 N--CA 1.437 -1.078 0 C-N-CA 125.339 1.455 . . . . 0.0 108.992 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -50.41 -73.77 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 126.668 1.987 . . . . 0.0 115.499 -175.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -105.83 -36.49 7.0 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.161 1.385 . . . . 0.0 113.703 -175.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.401 HG13 ' H ' ' A' ' 59' ' ' VAL . 1.8 m -60.8 159.86 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.452 0.701 . . . . 0.0 111.857 -175.333 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.77 151.04 23.52 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.197 0.599 . . . . 0.0 109.443 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.8 tp -150.6 168.04 25.47 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.383 1.473 . . . . 0.0 108.494 -176.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -131.58 154.95 48.32 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.079 0.551 . . . . 0.0 109.688 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -147.36 167.52 24.12 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 123.453 0.701 . . . . 0.0 112.339 176.434 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -141.09 123.28 15.65 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.8 t -136.12 130.79 48.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.03 114.14 16.61 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 176.605 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -118.24 170.75 8.63 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 124.36 1.064 . . . . 0.0 108.641 -175.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 89.8 m -136.34 116.76 13.7 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 120.451 -1.406 . . . . 0.0 110.558 -175.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.8 m -151.93 152.61 32.75 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.842 0.857 . . . . 0.0 111.756 179.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.14 172.97 49.59 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 -176.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -139.29 144.24 38.25 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 117.749 0.774 . . . . 0.0 109.943 -175.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.8 -179.14 6.58 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 127.965 2.506 . . . . 0.0 106.024 175.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 96.4 mtp -71.33 -5.64 33.98 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.415 0.686 . . . . 0.0 110.786 175.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.0 m -133.58 170.25 15.8 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 127.913 2.485 . . . . 0.0 107.827 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.9 mtmt -61.46 160.08 11.67 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.4 0.619 . . . . 0.0 110.522 176.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 -123.48 158.74 30.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 175.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.1 t -146.16 137.39 24.6 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 175.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -140.34 123.89 17.08 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -87.89 141.17 28.8 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.5 114.72 23.88 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.085 1.354 . . . . 0.0 109.282 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.33 113.57 21.24 Favored 'General case' 0 C--O 1.225 -0.237 0 N-CA-C 103.664 -2.717 . . . . 0.0 103.664 175.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.2 mt -105.31 142.66 17.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 m -126.27 123.57 38.4 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 175.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.7 t-105 -90.29 123.44 34.06 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 103.798 -2.668 . . . . 0.0 103.798 175.165 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 4.7 mm -137.56 86.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 103.563 -2.754 . . . . 0.0 103.563 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.76 147.36 6.89 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -178.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -54.29 -21.82 10.28 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.897 0.702 . . . . 0.0 112.897 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -83.12 -34.76 26.01 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 117.321 -1.323 . . . . 0.0 112.078 -175.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.82 136.09 26.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 120.489 1.495 . . . . 0.0 109.88 -178.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.7 t -145.82 176.71 9.46 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 127.125 2.17 . . . . 0.0 107.396 -176.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.72 -156.81 53.52 Favored Glycine 0 N--CA 1.45 -0.405 0 CA-C-O 121.535 0.519 . . . . 0.0 112.148 175.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 tt -51.63 -36.78 47.39 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.799 1.24 . . . . 0.0 111.269 -176.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.4 mp0 -63.7 -35.68 81.35 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 119.565 1.075 . . . . 0.0 112.141 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -76.06 -49.72 16.71 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 175.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.22 -29.21 63.55 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.299 1.44 . . . . 0.0 113.296 -175.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -48.47 -37.74 18.19 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 119.778 1.172 . . . . 0.0 111.415 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 20.3 m -58.16 -32.28 68.04 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.889 0.768 . . . . 0.0 111.893 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.24 -25.97 72.46 Favored Glycine 0 CA--C 1.53 0.985 0 O-C-N 120.86 -1.15 . . . . 0.0 112.34 177.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.5 m -105.75 -16.69 14.6 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.489 1.915 . . . . 0.0 111.633 -176.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -103.95 -25.85 12.87 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 126.086 1.754 . . . . 0.0 112.073 -175.202 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 19.3 mtmt -56.67 -26.65 56.96 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.453 1.479 . . . . 0.0 112.311 175.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -62.3 -38.31 88.88 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 118.942 0.792 . . . . 0.0 109.84 176.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.7 HD11 ' HB ' ' A' ' 6' ' ' THR . 39.6 mt -68.88 -61.41 1.81 Allowed 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 125.849 1.66 . . . . 0.0 109.576 -176.522 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.286 1.4 p -55.89 -30.87 29.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 118.052 -0.975 . . . . 0.0 108.514 176.15 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.55 -39.06 93.43 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 120.626 1.557 . . . . 0.0 109.617 175.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -54.95 -29.04 55.66 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 121.487 1.949 . . . . 0.0 111.701 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.46 HG11 ' HB3' ' A' ' 13' ' ' CYS . 79.7 t -86.1 -52.35 12.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 119.258 0.935 . . . . 0.0 109.227 175.571 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.2 t -79.21 14.82 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 129.432 3.093 . . . . 0.0 115.116 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -55.72 -26.21 44.17 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 122.381 2.355 . . . . 0.0 112.866 -176.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -84.85 63.7 8.19 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 175.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -137.47 176.4 8.74 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.674 0.789 . . . . 0.0 109.52 176.14 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.93 -66.38 1.0 Allowed 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 124.096 0.873 . . . . 0.0 110.216 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -148.26 176.21 10.44 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.818 1.647 . . . . 0.0 109.614 -176.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -121.37 171.94 8.4 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 125.021 1.328 . . . . 0.0 111.467 -177.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -145.61 147.98 32.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 17.2 t -126.32 125.68 67.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 175.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.3 mt -121.79 143.93 32.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 125.979 1.712 . . . . 0.0 109.214 -175.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.9 p -137.42 1.39 2.39 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -142.87 153.43 43.14 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -177.128 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -62.52 -38.74 91.14 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.719 0.69 . . . . 0.0 110.237 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -61.47 -45.28 94.94 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 119.091 0.859 . . . . 0.0 109.232 175.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -62.47 -23.94 67.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.813 1.245 . . . . 0.0 111.011 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -83.68 -23.86 31.54 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.074 1.75 . . . . 0.0 113.02 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -62.65 124.07 20.02 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.75 0.705 . . . . 0.0 112.127 -175.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.71 -26.07 66.88 Favored 'General case' 0 CA--C 1.527 0.077 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -56.7 -45.18 81.98 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -175.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -89.61 -24.42 21.68 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 117.961 -1.019 . . . . 0.0 109.102 178.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 24.8 mt -56.68 -40.92 72.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 N-CA-C 106.65 -1.611 . . . . 0.0 106.65 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.3 mtpm? -53.59 -52.46 59.72 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 118.593 0.633 . . . . 0.0 110.215 175.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 9.2 t -65.64 -37.94 87.96 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.468 0.707 . . . . 0.0 111.108 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -61.4 -53.88 50.82 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.85 1.66 . . . . 0.0 108.934 177.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 76.2 mt -62.0 -34.18 75.71 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 125.103 1.361 . . . . 0.0 110.098 175.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.03 -50.25 74.1 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 120.434 1.47 . . . . 0.0 110.643 175.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt -62.01 -49.65 75.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 120.352 1.433 . . . . 0.0 109.08 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -76.08 16.77 0.4 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.227 1.011 . . . . 0.0 111.988 175.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -69.74 -8.05 59.79 Favored Glycine 0 C--N 1.335 0.483 0 C-N-CA 125.971 1.748 . . . . 0.0 116.115 -174.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 63.59 62.04 5.68 Favored Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 107.589 -2.204 . . . . 0.0 107.589 -175.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.54 161.46 1.44 Allowed 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.783 0.833 . . . . 0.0 110.398 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -119.96 132.19 55.43 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -126.34 99.02 5.67 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 101.737 -3.431 . . . . 0.0 101.737 177.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -134.35 159.18 41.84 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.381 1.073 . . . . 0.0 110.553 -175.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -146.33 136.29 23.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.524 1.53 . . . . 0.0 107.125 177.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -140.66 151.64 44.74 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 104.999 -2.222 . . . . 0.0 104.999 176.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.7 m 85.72 56.56 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.78 2.032 . . . . 0.0 105.833 -175.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 . . . . . 0 C--O 1.257 1.487 0 N-CA-C 103.915 -2.624 . . . . 0.0 103.915 175.859 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.904 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 16.8 tt -53.55 112.76 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 122.608 1.194 . . . . 0.0 112.211 -156.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.37 156.48 42.13 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 129.058 2.943 . . . . 0.0 105.17 176.277 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 22.9 ttp -129.57 173.87 10.19 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 105.275 -2.12 . . . . 0.0 105.275 175.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -71.64 82.18 0.85 Allowed 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 175.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.6 m -63.56 157.72 22.97 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.005 1.722 . . . . 0.0 106.644 176.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.96 -173.04 2.66 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 120.668 -1.27 . . . . 0.0 112.021 -175.277 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.66 149.26 29.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 124.005 0.922 . . . . 0.0 109.413 177.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -94.6 71.08 3.61 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 103.554 -2.758 . . . . 0.0 103.554 175.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -56.67 -34.09 67.03 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-O 117.909 -1.044 . . . . 0.0 111.517 -175.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -70.09 -38.67 75.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 119.828 1.194 . . . . 0.0 110.615 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.81 -49.32 18.41 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 121.827 -0.546 . . . . 0.0 110.057 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.3 m -62.1 -38.02 87.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.699 -0.626 . . . . 0.0 111.56 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -62.49 -31.59 72.37 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 116.289 -1.815 . . . . 0.0 110.327 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.38 -54.38 47.48 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 120.766 1.621 . . . . 0.0 110.727 178.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.492 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -70.59 -40.06 73.47 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.516 -0.74 . . . . 0.0 111.486 -178.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -55.66 -43.01 75.9 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 118.406 -0.807 . . . . 0.0 109.683 176.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -57.54 -45.0 85.61 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.487 1.115 . . . . 0.0 111.043 -177.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mp -59.45 -63.04 1.44 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.324 0.65 . . . . 0.0 110.099 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.5 t -58.35 -30.56 40.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 123.108 0.563 . . . . 0.0 111.84 -176.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.24 -28.2 63.0 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.894 1.277 . . . . 0.0 111.342 175.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -71.18 155.73 40.4 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.682 0.673 . . . . 0.0 109.7 -174.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -86.43 -18.5 31.57 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.954 1.302 . . . . 0.0 113.297 177.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.29 -2.43 38.38 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 125.155 1.359 . . . . 0.0 114.586 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.3 t -69.66 135.34 49.77 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 119.574 1.687 . . . . 0.0 110.407 -178.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.74 -25.52 56.63 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 55.2 t -78.27 123.9 35.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 175.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.2 pp -112.66 -23.7 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.673 1.189 . . . . 0.0 111.155 -176.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 38.2 p-90 -130.05 153.69 48.19 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 122.013 0.911 . . . . 0.0 111.008 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.492 HG21 ' HB1' ' A' ' 16' ' ' ALA . 5.2 t -139.6 165.89 21.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 128.579 2.752 . . . . 0.0 108.622 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 30.9 p -126.0 160.86 28.92 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.487 1.115 . . . . 0.0 109.0 175.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -132.86 126.67 32.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.8 mmmt -109.44 171.5 7.41 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.421 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 49.6 m-85 -121.65 143.68 49.2 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 175.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -139.19 123.54 18.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 35.43 -98.98 0.01 OUTLIER Glycine 0 CA--C 1.532 1.099 0 C-N-CA 126.916 2.198 . . . . 0.0 115.068 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 m -104.4 18.3 22.43 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.253 1.421 . . . . 0.0 113.941 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.2 t -146.37 169.0 19.75 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 120.748 1.613 . . . . 0.0 114.166 -175.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.421 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 17.5 mm -99.21 132.96 43.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 104.39 -2.448 . . . . 0.0 104.39 175.339 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.3 m -126.16 154.96 74.34 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 175.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.75 162.87 36.85 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 CA-C-N 121.357 1.52 . . . . 0.0 109.565 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.5 -158.63 10.43 Favored Glycine 0 CA--C 1.523 0.575 0 C-N-CA 126.517 2.008 . . . . 0.0 108.69 175.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -60.23 167.59 2.35 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 122.073 0.939 . . . . 0.0 112.694 176.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -138.0 161.64 36.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.752 2.021 . . . . 0.0 110.271 -175.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.42 176.74 43.93 Favored Glycine 0 CA--C 1.527 0.785 0 CA-C-O 122.029 0.794 . . . . 0.0 113.346 178.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -125.77 -3.46 7.15 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.494 1.918 . . . . 0.0 112.042 -176.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -131.22 127.78 38.6 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 127.27 2.228 . . . . 0.0 105.889 -175.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -83.17 -15.85 48.97 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 118.357 -0.83 . . . . 0.0 109.407 -175.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -55.82 -36.31 67.34 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 120.139 1.336 . . . . 0.0 109.595 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -65.63 -29.27 69.82 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 118.406 -0.806 . . . . 0.0 112.015 176.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.426 ' CD1' HD11 ' A' ' 123' ' ' LEU . 1.0 OUTLIER -61.27 -51.67 67.93 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 124.42 1.088 . . . . 0.0 108.936 178.953 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.8 mp -62.75 -34.7 67.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 O-C-N 121.665 -0.647 . . . . 0.0 109.648 -175.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -73.92 -35.0 64.56 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.131 0.878 . . . . 0.0 111.226 176.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -61.93 -33.42 74.23 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.939 1.296 . . . . 0.0 112.893 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 89.9 m -50.64 121.49 5.89 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.077 0.951 . . . . 0.0 110.337 -176.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 p -84.15 170.69 13.55 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 128.532 2.733 . . . . 0.0 111.798 -176.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 10.2 p-10 -69.9 -76.87 0.09 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.942 2.097 . . . . 0.0 115.957 -174.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.423 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 3.2 t70 -106.51 -30.57 8.98 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 127.106 2.162 . . . . 0.0 112.402 -176.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.5 m -55.18 156.24 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-O 122.966 1.365 . . . . 0.0 111.451 -175.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.0 123.81 48.72 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 176.323 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.5 tp -129.29 165.98 20.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.628 1.571 . . . . 0.0 109.317 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -132.01 152.25 51.25 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.484 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -138.01 155.05 49.24 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.009 1.324 . . . . 0.0 111.268 177.038 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -127.9 123.49 35.12 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.956 -2.239 . . . . 0.0 104.956 177.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.1 t -132.5 135.77 57.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -80.48 123.69 28.28 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 175.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -126.25 169.88 12.43 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.929 1.292 . . . . 0.0 108.029 -176.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -136.05 113.36 10.66 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 120.162 -1.586 . . . . 0.0 108.683 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.8 m -156.38 151.6 26.51 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.75 1.62 . . . . 0.0 106.633 175.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 113.06 113.27 3.17 Favored Glycine 0 N--CA 1.441 -0.995 0 N-CA-C 103.296 -3.922 . . . . 0.0 103.296 -175.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -89.97 113.88 25.61 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 111.942 -2.129 . . . . 0.0 106.449 -175.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.57 176.72 9.61 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.248 1.019 . . . . 0.0 110.363 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 69.4 mtm -66.35 -5.77 11.9 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.574 1.55 . . . . 0.0 113.397 176.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.3 m -146.33 170.64 16.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 119.998 -1.689 . . . . 0.0 108.795 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -61.56 151.41 33.23 Favored 'General case' 0 C--N 1.339 0.136 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 177.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -137.47 161.97 34.92 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 103.796 -2.668 . . . . 0.0 103.796 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.1 t -142.05 149.14 39.55 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 176.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -131.15 172.38 12.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -141.69 139.67 33.0 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 177.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -116.47 117.58 30.3 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -176.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.421 HD22 ' O ' ' A' ' 63' ' ' ALA . 1.7 tm? -91.47 113.64 25.96 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 102.138 -3.282 . . . . 0.0 102.138 175.209 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.3 mp -105.75 125.73 61.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -101.84 123.51 45.9 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 56.0 t-105 -95.33 123.41 38.84 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 104.729 -2.323 . . . . 0.0 104.729 175.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.3 mt -143.92 98.36 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 -179.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -63.32 166.79 24.69 Favored Glycine 0 CA--C 1.534 1.226 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 175.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -77.97 -12.01 59.95 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.344 -1.68 . . . . 0.0 110.628 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -83.07 -27.43 30.27 Favored 'General case' 0 C--O 1.237 0.426 0 O-C-N 120.14 -1.6 . . . . 0.0 112.17 -175.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.3 p -67.43 123.85 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 104.75 -2.315 . . . . 0.0 104.75 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.7 t -66.23 158.73 28.13 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 122.203 1.001 . . . . 0.0 111.4 -175.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.92 -24.43 49.81 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.411 1.482 . . . . 0.0 113.196 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 9.8 tt -67.99 -50.79 53.5 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-N 119.354 1.577 . . . . 0.0 109.641 176.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -63.96 -43.65 95.16 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 176.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 42.3 ttp85 -55.09 -35.81 64.98 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 118.391 0.541 . . . . 0.0 111.249 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.63 -26.62 65.63 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 118.025 -0.988 . . . . 0.0 111.888 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -57.15 -39.47 75.27 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 121.115 1.78 . . . . 0.0 111.371 175.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 38.1 m -55.5 -28.22 53.31 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 119.948 1.249 . . . . 0.0 110.99 175.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.44 -20.58 67.84 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.409 1.481 . . . . 0.0 114.406 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 92.4 m -120.9 -6.96 9.55 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.909 1.284 . . . . 0.0 110.89 176.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -104.19 -24.96 13.1 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-O 118.247 -0.882 . . . . 0.0 113.169 -175.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -58.63 -24.04 60.28 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 121.248 1.84 . . . . 0.0 111.434 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -69.65 -41.25 75.82 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 120.197 1.362 . . . . 0.0 108.608 175.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 25.4 mt -57.5 -63.04 1.37 Allowed 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 126.193 1.797 . . . . 0.0 111.408 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.429 HG12 ' H ' ' A' ' 104' ' ' VAL . 0.9 OUTLIER -59.53 -29.65 42.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.059 176.142 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -72.14 -25.06 61.56 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-O 116.882 -1.532 . . . . 0.0 111.714 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -61.64 -38.53 88.03 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 122.061 2.209 . . . . 0.0 109.713 175.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 98.9 t -72.97 -60.37 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 175.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 39.3 t -77.79 26.45 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 129.153 2.981 . . . . 0.0 112.927 -175.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -57.19 -26.36 60.51 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 119.713 -1.867 . . . . 0.0 110.751 -177.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -84.3 72.49 10.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.92 1.288 . . . . 0.0 107.854 175.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -145.03 174.63 10.87 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 122.826 0.45 . . . . 0.0 110.878 176.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.35 -66.2 0.93 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 118.507 -0.759 . . . . 0.0 109.865 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.38 176.41 11.71 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.702 2.001 . . . . 0.0 108.721 178.095 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -106.4 173.5 6.29 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 123.568 0.747 . . . . 0.0 112.204 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.47 ' CD1' HD11 ' A' ' 117' ' ' ILE . 0.7 OUTLIER -143.4 155.04 44.29 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 103.126 -2.916 . . . . 0.0 103.126 -179.9 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 14.7 t -131.84 129.52 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 O-C-N 120.61 -1.306 . . . . 0.0 107.679 175.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.47 HD11 ' CD1' ' A' ' 115' ' ' PHE . 2.6 mp -133.97 148.1 30.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 125.509 1.524 . . . . 0.0 107.835 -178.059 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 7.7 p -130.85 -8.45 3.97 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.454 1.902 . . . . 0.0 113.966 -176.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -124.22 124.27 42.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -176.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.9 ttp85 -60.17 -30.56 69.41 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.316 -178.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -74.66 -26.18 59.69 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 119.83 1.195 . . . . 0.0 111.909 175.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.31 -40.54 43.95 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -177.166 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.426 HD11 ' CD1' ' A' ' 51' ' ' PHE . 2.3 tm? -45.18 -23.32 0.16 Allowed 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 130.195 3.398 . . . . 0.0 116.279 -175.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -48.15 130.54 15.88 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 125.476 1.51 . . . . 0.0 111.782 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -56.12 -16.48 5.19 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 176.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.262 30.2 t70 -58.1 -56.42 22.31 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 117.565 -1.207 . . . . 0.0 112.988 -175.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -77.09 -26.36 53.32 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 116.459 -2.096 . . . . 0.0 107.608 -175.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 51.4 mt -55.72 -40.84 62.77 Favored 'Isoleucine or valine' 0 C--N 1.343 0.302 0 C-N-CA 124.836 1.254 . . . . 0.0 108.331 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.2 mtmm -54.35 -52.17 62.43 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.915 0.779 . . . . 0.0 110.438 175.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 47.5 t -63.93 -44.25 93.43 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 117.962 -1.018 . . . . 0.0 109.47 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -63.85 -40.54 96.82 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.731 1.605 . . . . 0.0 110.687 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.44 -32.68 74.42 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.754 0.821 . . . . 0.0 109.358 175.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 46.3 mmtt -76.31 -38.53 55.9 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.412 1.485 . . . . 0.0 112.083 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -59.86 -57.24 13.73 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 125.998 1.719 . . . . 0.0 106.79 175.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.73 -3.38 21.62 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.461 0.705 . . . . 0.0 112.582 175.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -93.19 -54.85 1.66 Allowed Glycine 0 C--N 1.333 0.371 0 C-N-CA 125.056 1.312 . . . . 0.0 111.121 -176.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 65.82 178.1 7.76 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 122.16 0.867 . . . . 0.0 111.212 -175.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -153.06 85.83 1.23 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -144.38 121.44 11.42 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -136.31 84.56 2.08 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 104.5 -2.407 . . . . 0.0 104.5 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -156.0 136.32 13.07 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 127.592 2.357 . . . . 0.0 107.354 -175.601 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.03 93.25 1.42 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.985 1.314 . . . . 0.0 108.582 176.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -93.51 62.47 3.34 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.446 -0.784 . . . . 0.0 109.615 -176.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 84.5 56.14 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 127.52 2.328 . . . . 0.0 106.012 -175.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.224 1.81 . . . . 0.0 107.912 -175.735 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.912 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 29.1 mt -131.72 155.76 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 168.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -122.72 109.18 13.92 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 103.62 -2.733 . . . . 0.0 103.62 175.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.55 176.18 5.24 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.062 0.945 . . . . 0.0 110.043 -175.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -75.79 52.25 0.67 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.665 1.586 . . . . 0.0 111.533 177.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.634 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.8 m -111.9 171.92 7.21 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 128.06 2.544 . . . . 0.0 106.298 176.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.7 mmtp -140.48 178.99 6.92 Favored 'General case' 0 CA--C 1.513 -0.446 0 O-C-N 121.219 -0.926 . . . . 0.0 111.332 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.401 ' H ' HD13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -126.23 150.49 31.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 124.58 1.152 . . . . 0.0 109.441 179.243 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -95.05 83.42 3.93 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 101.759 -3.423 . . . . 0.0 101.759 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -61.99 -29.36 70.2 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 117.324 -1.322 . . . . 0.0 112.93 -175.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -69.09 -59.22 3.18 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.629 1.104 . . . . 0.0 108.346 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.62 95.68 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 122.667 0.387 . . . . 0.0 111.276 -176.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 85.7 m -73.97 -33.21 63.79 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.56 -0.733 . . . . 0.0 110.781 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.7 ttt-85 -63.92 -37.1 86.17 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 116.979 -1.486 . . . . 0.0 108.53 175.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.75 -46.91 87.71 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 120.351 1.432 . . . . 0.0 110.679 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.469 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -61.26 -50.78 71.67 Favored 'General case' 0 N--CA 1.462 0.137 0 O-C-N 121.553 -0.717 . . . . 0.0 111.523 176.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -51.39 -47.53 62.87 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.581 0.752 . . . . 0.0 110.293 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.89 -49.55 77.24 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.417 1.887 . . . . 0.0 111.0 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mp -59.52 -51.14 71.14 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 120.275 1.398 . . . . 0.0 111.205 175.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.415 ' CG2' HG23 ' A' ' 30' ' ' VAL . 79.2 t -60.93 -30.4 47.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 O-C-N 121.741 -0.599 . . . . 0.0 110.033 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.15 -38.74 60.87 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.375 1.07 . . . . 0.0 112.973 175.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -67.46 123.36 20.18 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -175.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.67 -32.16 68.85 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 124.666 1.186 . . . . 0.0 112.205 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.0 -11.47 82.51 Favored Glycine 0 CA--C 1.526 0.757 0 CA-C-O 119.374 -0.681 . . . . 0.0 112.45 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.0 t -81.19 123.62 28.6 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 118.961 1.381 . . . . 0.0 107.552 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.48 -23.89 62.77 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.608 175.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 t -67.23 123.69 20.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -108.32 -23.78 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 C-N-CA 124.315 1.046 . . . . 0.0 110.06 178.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.422 ' HB2' HG22 ' A' ' 65' ' ' VAL . 10.5 p-90 -131.05 138.99 49.86 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.802 0.841 . . . . 0.0 110.502 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.469 HG11 ' HB1' ' A' ' 16' ' ' ALA . 62.0 t -136.34 149.96 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 175.078 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.465 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 23.3 p -104.34 159.76 15.45 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 176.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -124.45 123.82 40.97 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 175.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -98.45 175.78 5.91 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 176.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -127.03 124.05 38.45 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 106.781 -1.562 . . . . 0.0 106.781 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -112.69 123.42 50.27 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 104.261 -2.496 . . . . 0.0 104.261 175.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 23.04 -88.86 0.01 OUTLIER Glycine 0 CA--C 1.529 0.961 0 C-N-CA 127.661 2.553 . . . . 0.0 116.683 -176.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 65.0 p -92.66 2.22 56.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.059 2.143 . . . . 0.0 116.175 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -150.63 175.83 11.57 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.233 1.379 . . . . 0.0 114.647 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 11.6 mm -93.69 136.26 25.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 128.036 2.534 . . . . 0.0 106.256 175.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.8 m -135.31 159.36 72.09 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-O 118.475 -0.774 . . . . 0.0 110.561 176.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.12 155.46 47.24 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 121.753 1.635 . . . . 0.0 110.288 175.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -120.45 -152.86 9.0 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 126.668 2.08 . . . . 0.0 109.728 176.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.42 164.97 5.11 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.491 1.117 . . . . 0.0 110.736 176.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -145.03 162.29 37.31 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.252 1.421 . . . . 0.0 110.127 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.72 176.7 42.91 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-O 122.055 0.809 . . . . 0.0 112.512 -179.052 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -125.46 -6.07 7.04 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.049 1.739 . . . . 0.0 111.965 -176.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.23 141.9 43.99 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 -177.17 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -83.89 -14.52 50.87 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -174.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -60.56 -36.11 77.68 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 119.885 -1.76 . . . . 0.0 109.564 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -71.7 -22.76 61.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.323 1.049 . . . . 0.0 112.034 175.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -67.09 -43.57 82.2 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.339 1.056 . . . . 0.0 109.522 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.0 mm -54.32 -47.24 69.3 Favored 'Isoleucine or valine' 0 C--N 1.342 0.245 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -176.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.3 mm-40 -65.03 -23.93 67.34 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.53 0.732 . . . . 0.0 112.502 -176.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -77.39 -24.26 50.56 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 119.444 1.02 . . . . 0.0 111.359 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.2 m -73.83 113.62 11.19 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.07 -1.455 . . . . 0.0 107.07 177.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.31 2.1 p -100.73 178.39 4.72 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.892 1.277 . . . . 0.0 110.594 -176.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.09 -76.15 0.1 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 117.951 2.574 . . . . 0.0 117.951 -174.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.39 -27.8 19.09 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 120.226 1.375 . . . . 0.0 114.569 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.7 m -70.63 169.66 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 120.895 -1.128 . . . . 0.0 112.165 -175.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.441 ' H ' ' HD3' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -121.3 144.77 48.45 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.805 1.242 . . . . 0.0 107.986 178.059 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.9 tp -146.79 166.63 26.06 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.058 1.743 . . . . 0.0 107.702 -176.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -133.08 157.82 44.31 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 176.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.71 153.51 41.06 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 118.744 0.702 . . . . 0.0 111.139 175.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.403 ' CE1' ' HB3' ' A' ' 79' ' ' PHE . 54.7 t80 -119.86 123.64 44.12 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 104.536 -2.394 . . . . 0.0 104.536 175.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.422 HG22 ' HB2' ' A' ' 29' ' ' TRP . 39.3 t -135.15 138.72 48.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 O-C-N 123.222 0.326 . . . . 0.0 110.209 -175.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.7 ttm180 -75.41 117.85 17.65 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.639 1.976 . . . . 0.0 106.949 175.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -131.88 150.92 52.01 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 84.7 m -111.69 113.3 25.59 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 121.517 -0.74 . . . . 0.0 111.153 -175.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.8 m -156.69 130.69 8.43 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 175.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.34 151.14 5.64 Favored Glycine 0 CA--C 1.519 0.307 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 176.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -124.4 124.57 42.63 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 -175.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.8 179.56 7.49 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.504 1.922 . . . . 0.0 107.161 175.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 60.8 mtm -65.97 -6.84 13.92 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.501 0.591 . . . . 0.0 111.713 175.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.2 m -146.0 176.43 9.71 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.955 2.102 . . . . 0.0 109.845 -175.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.416 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 2.4 mptp? -55.78 143.35 31.34 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.379 0.671 . . . . 0.0 109.585 177.264 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -119.38 162.46 18.76 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 t -139.55 151.73 46.32 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.3 mttp -146.39 175.81 10.26 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.686 1.995 . . . . 0.0 107.076 176.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.403 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . 92.1 m-85 -140.26 134.69 31.4 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 175.266 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -104.83 114.26 28.36 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 124.877 1.361 . . . . 0.0 107.401 177.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -83.47 113.53 20.84 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 102.339 -3.208 . . . . 0.0 102.339 175.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 mt -96.75 142.66 13.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 -176.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.3 m -125.59 123.46 39.08 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 104.382 -2.451 . . . . 0.0 104.382 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 39.5 t-105 -103.06 124.28 48.24 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 104.825 -2.287 . . . . 0.0 104.825 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 mm -125.54 110.06 23.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 103.562 -2.755 . . . . 0.0 103.562 175.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.441 ' O ' HG12 ' A' ' 89' ' ' VAL . . . -54.96 126.8 39.54 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 107.643 -2.183 . . . . 0.0 107.643 175.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.53 -12.25 2.58 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 118.786 1.293 . . . . 0.0 112.833 -175.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -83.77 -30.68 26.43 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 117.324 -1.322 . . . . 0.0 111.401 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.441 HG12 ' O ' ' A' ' 86' ' ' GLY . 8.4 p -74.14 143.82 13.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 121.083 1.765 . . . . 0.0 111.392 -175.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.0 t -143.16 176.69 8.93 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.463 1.905 . . . . 0.0 106.938 175.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 79.58 -156.32 40.65 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 176.006 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.0 tt -59.27 -42.52 91.41 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.404 1.081 . . . . 0.0 112.535 -175.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -33.62 73.86 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 120.706 1.594 . . . . 0.0 111.536 -176.378 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.31 -50.33 27.83 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 175.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.34 -27.02 67.03 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 125.17 1.388 . . . . 0.0 113.41 -176.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -46.26 -41.32 12.85 Favored 'General case' 0 CA--C 1.502 -0.889 0 C-N-CA 124.489 1.116 . . . . 0.0 110.205 175.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.2 m -52.79 -39.6 62.47 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.422 1.089 . . . . 0.0 111.144 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -74.86 -10.31 83.59 Favored Glycine 0 CA--C 1.532 1.146 0 O-C-N 121.351 -0.843 . . . . 0.0 113.612 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 47.2 m -112.46 -15.14 13.15 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.358 1.863 . . . . 0.0 110.763 177.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -104.31 -29.33 10.85 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 126.504 1.921 . . . . 0.0 112.898 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -54.41 -33.04 58.59 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 119.901 1.228 . . . . 0.0 112.885 177.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.8 t -63.95 -34.19 77.43 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 118.842 0.746 . . . . 0.0 111.412 176.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.634 HD11 ' HB ' ' A' ' 6' ' ' THR . 30.8 mt -67.76 -61.82 1.7 Allowed 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 125.678 1.591 . . . . 0.0 109.478 -175.704 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -58.67 -33.33 48.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-O 118.147 -0.93 . . . . 0.0 109.173 175.512 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 63.0 tttt -64.92 -42.07 95.03 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 120.481 1.491 . . . . 0.0 110.232 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.78 -26.06 61.4 Favored 'General case' 0 C--N 1.335 -0.048 0 CA-C-N 119.146 0.885 . . . . 0.0 111.952 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 69.7 t -84.27 -61.74 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 175.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.05 26.53 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 129.843 3.257 . . . . 0.0 113.448 -175.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -50.54 -26.78 5.61 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 119.895 -1.753 . . . . 0.0 112.491 -176.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -88.75 74.49 8.33 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 175.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -140.04 161.0 38.66 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 175.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -87.49 -66.83 0.87 Allowed 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.201 -176.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.99 176.34 12.32 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 129.615 3.166 . . . . 0.0 108.698 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -119.89 165.73 14.24 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.345 1.058 . . . . 0.0 112.74 -175.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -133.94 147.31 51.05 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 104.311 -2.478 . . . . 0.0 104.311 -175.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.8 t -123.14 129.52 74.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 176.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -132.9 141.14 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 125.26 1.424 . . . . 0.0 107.752 -176.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 p -139.38 -2.26 1.63 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 175.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -129.07 151.35 49.85 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 124.512 1.125 . . . . 0.0 110.182 178.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 40.8 ttp-105 -58.19 -45.43 87.59 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 123.103 0.561 . . . . 0.0 110.881 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -65.66 -23.48 66.8 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.65 0.659 . . . . 0.0 110.539 -176.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -83.37 -23.25 32.53 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.9 2.08 . . . . 0.0 110.986 175.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -77.35 -23.29 50.9 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.692 1.597 . . . . 0.0 112.536 178.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 -63.4 123.78 19.59 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -175.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -49.69 -25.25 2.77 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 119.28 3.067 . . . . 0.0 119.28 175.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -63.33 -56.26 17.83 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 119.335 0.971 . . . . 0.0 113.154 -175.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -78.37 -26.09 46.52 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 118.0 -1.48 . . . . 0.0 109.152 -177.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 19.4 mt -52.7 -40.5 34.81 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 C-N-CA 124.899 1.28 . . . . 0.0 108.926 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 33.8 mttp -54.8 -49.49 70.84 Favored 'General case' 0 N--CA 1.457 -0.075 0 CA-C-N 118.213 0.46 . . . . 0.0 111.766 176.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 35.1 t -72.0 -36.31 69.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.059 0.544 . . . . 0.0 111.379 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.15 -46.03 91.05 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 119.466 1.03 . . . . 0.0 108.603 176.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 74.1 mt -66.6 -23.92 66.25 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 123.849 0.86 . . . . 0.0 110.883 175.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 16.1 mttt -73.0 -47.81 41.88 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 120.413 1.461 . . . . 0.0 107.182 175.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -61.44 -60.78 3.19 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.716 0.806 . . . . 0.0 109.036 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.37 1.22 1.71 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.087 1.355 . . . . 0.0 112.124 175.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -38.76 106.5 0.05 OUTLIER Glycine 0 C--N 1.337 0.619 0 C-N-CA 128.368 2.89 . . . . 0.0 111.962 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -66.26 102.46 0.73 Allowed Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 106.668 -2.573 . . . . 0.0 106.668 175.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.03 144.68 18.63 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 -179.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -144.25 122.82 12.48 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -176.093 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -134.66 97.08 3.69 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 105.253 -2.128 . . . . 0.0 105.253 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -146.67 88.48 1.77 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.472 -1.24 . . . . 0.0 107.825 -175.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -101.05 95.13 6.37 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.741 1.216 . . . . 0.0 110.202 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -149.12 77.33 1.36 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.006 1.323 . . . . 0.0 108.456 175.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 4.8 m 60.53 56.03 3.22 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.547 1.139 . . . . 0.0 109.662 -178.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 125.825 1.65 . . . . 0.0 109.855 178.434 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.761 0 N-CA-C 110.466 -1.054 . . . . 0.0 110.466 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.4 tt -74.3 33.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 C-N-CA 124.793 1.237 . . . . 0.0 112.546 -174.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 67.7 mtt85 -135.93 119.1 16.56 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 127.397 2.279 . . . . 0.0 106.518 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 91.4 mtp -77.49 23.56 0.22 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.439 1.095 . . . . 0.0 111.186 176.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.75 62.64 7.51 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 125.598 1.559 . . . . 0.0 108.028 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.9 m -142.99 158.27 43.76 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.608 1.563 . . . . 0.0 106.962 -175.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -132.66 -171.73 2.73 Favored 'General case' 0 CA--C 1.518 -0.282 0 O-C-N 121.273 -0.892 . . . . 0.0 111.92 -175.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.9 152.9 33.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 C-N-CA 124.388 1.075 . . . . 0.0 110.913 176.462 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -99.78 85.0 3.0 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 100.601 -3.851 . . . . 0.0 100.601 174.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -61.24 -24.3 66.27 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 117.166 -1.397 . . . . 0.0 112.54 -175.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -76.95 -54.18 6.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 120.786 1.63 . . . . 0.0 109.205 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.11 -36.33 83.23 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.768 -0.583 . . . . 0.0 111.043 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 79.5 m -75.56 -38.84 58.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 118.966 -0.54 . . . . 0.0 111.526 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.7 ttt-85 -60.06 -34.53 73.55 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-O 116.789 -1.577 . . . . 0.0 109.024 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.87 -56.6 18.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 120.596 1.544 . . . . 0.0 110.509 -177.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.656 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -61.42 -43.69 98.44 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 118.507 0.594 . . . . 0.0 111.751 179.034 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -55.24 -44.19 75.27 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -59.51 -41.95 91.11 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.327 1.451 . . . . 0.0 111.105 -176.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.37 -60.99 2.77 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 123.984 0.802 . . . . 0.0 109.88 175.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.498 ' CG2' HG23 ' A' ' 30' ' ' VAL . 71.0 t -59.06 -31.64 46.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 122.978 0.511 . . . . 0.0 111.58 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -37.25 86.92 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 125.872 1.669 . . . . 0.0 110.769 176.024 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -81.59 123.21 28.48 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 124.013 0.821 . . . . 0.0 109.68 -176.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.13 -17.87 64.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 118.596 -0.716 . . . . 0.0 112.884 175.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.28 -12.44 80.67 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.737 1.16 . . . . 0.0 113.061 176.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.1 t -80.06 137.9 36.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 119.559 1.68 . . . . 0.0 109.038 -177.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -74.34 -18.59 60.67 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.233 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.0 t -82.45 123.83 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 106.495 -1.668 . . . . 0.0 106.495 176.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -113.64 -23.65 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.66 -178.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 26.5 p-90 -129.48 135.49 48.7 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.636 0.774 . . . . 0.0 109.19 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.656 HG11 ' HB1' ' A' ' 16' ' ' ALA . 33.4 t -136.03 166.34 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 175.392 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 65.1 p -123.55 161.67 24.48 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.946 0.898 . . . . 0.0 109.757 175.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -128.18 123.7 34.98 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 175.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -95.21 176.16 6.33 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 178.014 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -122.53 140.35 52.87 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -142.12 143.46 33.03 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.728 1.611 . . . . 0.0 107.219 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 36.62 -104.69 0.03 OUTLIER Glycine 0 CA--C 1.528 0.857 0 C-N-CA 126.281 1.896 . . . . 0.0 113.55 -177.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.7 p -125.08 33.53 5.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.629 1.572 . . . . 0.0 111.224 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.2 t -142.78 175.85 9.51 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 122.022 0.915 . . . . 0.0 111.812 176.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.5 mm -102.92 137.96 29.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 126.035 1.734 . . . . 0.0 106.432 177.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.13 165.28 33.4 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 123.78 0.832 . . . . 0.0 109.583 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.78 168.33 24.86 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 121.842 1.695 . . . . 0.0 111.607 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.24 -170.74 12.08 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 126.495 1.998 . . . . 0.0 109.472 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -61.33 161.8 8.65 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.105 1.362 . . . . 0.0 111.215 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -145.13 174.11 11.34 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.06 1.344 . . . . 0.0 111.336 -178.151 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.39 -175.92 42.35 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 124.074 0.845 . . . . 0.0 111.568 177.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.96 -26.61 6.82 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 125.941 1.696 . . . . 0.0 110.134 175.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -108.15 130.47 55.12 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -82.96 -10.3 58.86 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -174.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 42.1 tt0 -54.09 -39.34 66.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 120.746 1.612 . . . . 0.0 111.156 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -56.93 -38.6 73.11 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.929 1.292 . . . . 0.0 111.769 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -59.0 -37.62 77.3 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.743 1.217 . . . . 0.0 108.525 -177.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.8 mm -61.96 -49.76 82.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -175.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -66.72 -32.42 73.71 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.52 0.6 . . . . 0.0 111.817 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -60.83 -38.89 87.01 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-O 118.786 -0.626 . . . . 0.0 111.192 -176.283 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.3 m -57.75 118.68 5.54 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.049 0.94 . . . . 0.0 110.442 -176.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.505 ' OG1' HG22 ' A' ' 59' ' ' VAL . 2.5 p -83.92 -173.9 4.98 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 129.28 3.032 . . . . 0.0 111.943 -176.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 19.9 p-10 -78.34 -70.29 0.5 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.112 0.965 . . . . 0.0 111.553 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -106.24 -36.34 6.9 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.378 1.871 . . . . 0.0 113.807 -175.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.505 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -60.41 129.86 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -175.399 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.82 141.95 35.23 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.289 1.835 . . . . 0.0 106.19 -175.477 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 tp -142.5 169.36 17.71 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.56 1.144 . . . . 0.0 110.892 -174.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.662 ' CZ ' HG23 ' A' ' 97' ' ' THR . 11.3 m-85 -124.43 143.57 50.55 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.025 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -128.0 147.72 50.51 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 125.723 1.609 . . . . 0.0 110.331 176.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -121.31 124.06 43.67 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 104.394 -2.447 . . . . 0.0 104.394 177.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.5 t -136.8 143.6 34.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 O-C-N 123.358 0.411 . . . . 0.0 110.804 -175.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.3 119.04 25.23 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.315 1.446 . . . . 0.0 107.517 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -136.39 126.93 26.92 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.451 1.1 . . . . 0.0 109.048 -176.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.5 m -74.13 113.74 11.66 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 124.591 1.157 . . . . 0.0 110.169 -175.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 m -145.33 157.27 44.08 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 119.429 1.013 . . . . 0.0 111.025 176.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.7 125.59 2.83 Favored Glycine 0 C--N 1.333 0.403 0 C-N-CA 126.958 2.218 . . . . 0.0 110.341 176.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -83.56 122.8 29.05 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 126.596 1.958 . . . . 0.0 107.931 -175.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.62 172.36 13.71 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 125.778 1.631 . . . . 0.0 107.073 175.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -79.77 -6.9 58.18 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.04 0.536 . . . . 0.0 110.324 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.5 m -114.64 170.61 8.19 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 127.447 2.299 . . . . 0.0 110.442 -175.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -71.34 149.29 46.22 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 105.353 -2.092 . . . . 0.0 105.353 175.051 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -133.63 154.56 50.81 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 175.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.2 t -145.09 128.76 17.17 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -135.3 175.7 9.34 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -138.89 141.21 38.57 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.291 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -115.87 134.18 55.26 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 125.899 1.68 . . . . 0.0 107.438 -178.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -102.92 113.57 27.12 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 175.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mp -107.13 138.73 31.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 -175.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.3 m -121.32 123.47 42.24 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 104.766 -2.309 . . . . 0.0 104.766 -177.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -93.02 123.35 36.21 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 176.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.575 HD11 HG21 ' A' ' 97' ' ' THR . 5.9 mm -145.45 85.46 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 -177.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.655 ' O ' HG12 ' A' ' 89' ' ' VAL . . . -56.25 153.91 16.64 Favored Glycine 0 CA--C 1.532 1.136 0 O-C-N 121.551 -0.718 . . . . 0.0 112.205 -175.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -61.57 -19.44 62.17 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.565 -1.55 . . . . 0.0 112.132 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -83.36 -13.59 54.65 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 121.103 -0.998 . . . . 0.0 111.715 -176.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.655 HG12 ' O ' ' A' ' 86' ' ' GLY . 12.7 p -72.64 131.93 34.12 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-N 120.001 1.273 . . . . 0.0 110.007 179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.8 t -60.14 149.46 32.66 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.95 0.9 . . . . 0.0 109.367 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.53 -26.5 59.75 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.2 tt -68.89 -51.11 43.59 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 119.201 1.5 . . . . 0.0 110.668 177.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 19.9 mp0 -60.99 -38.82 87.35 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.315 -0.866 . . . . 0.0 109.5 175.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -61.62 -32.5 72.64 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.753 0.821 . . . . 0.0 111.248 175.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.79 -23.87 67.38 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.394 177.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.46 -54.05 50.24 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.913 1.688 . . . . 0.0 107.885 175.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.662 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 58.6 m -51.99 -38.22 55.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.864 0.866 . . . . 0.0 108.892 175.432 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -57.89 -19.87 38.67 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.067 1.318 . . . . 0.0 115.413 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 10.8 m -119.15 -2.94 10.64 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.816 1.808 . . . . 0.0 111.283 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -103.03 -23.7 13.67 Favored 'General case' 0 CA--C 1.516 -0.334 0 O-C-N 121.107 -0.995 . . . . 0.0 112.897 -175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -49.77 -39.23 37.26 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.495 1.498 . . . . 0.0 112.604 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.8 t -59.87 -30.48 69.02 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.368 0.531 . . . . 0.0 111.753 -179.193 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.4 mt -64.47 -63.36 1.15 Allowed 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 124.562 1.145 . . . . 0.0 109.014 -178.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.436 HG12 ' H ' ' A' ' 104' ' ' VAL 0.251 0.9 OUTLIER -59.29 -29.38 41.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 118.603 -0.713 . . . . 0.0 109.655 175.83 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -63.32 -47.25 83.01 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 120.104 1.32 . . . . 0.0 109.017 175.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -52.42 -30.67 30.56 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.103 1.361 . . . . 0.0 111.92 -178.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 91.9 t -84.02 -54.41 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.054 0.942 . . . . 0.0 109.682 176.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 47.6 t -86.32 26.12 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 127.39 2.276 . . . . 0.0 114.081 -175.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -53.1 -26.55 16.78 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 119.749 -1.844 . . . . 0.0 114.752 -175.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -91.4 83.52 5.45 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -145.65 175.4 10.4 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 126.135 1.774 . . . . 0.0 107.759 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -101.95 -66.21 0.94 Allowed 'General case' 0 C--O 1.234 0.275 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -175.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -144.35 172.52 12.82 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 125.043 1.337 . . . . 0.0 109.598 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -126.59 168.37 14.4 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.159 0.984 . . . . 0.0 110.647 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -148.44 157.59 43.57 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 105.302 -2.11 . . . . 0.0 105.302 -175.202 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.4 t -131.8 124.19 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -123.92 141.53 43.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -179.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.3 p -129.26 3.2 5.17 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.517 1.127 . . . . 0.0 113.726 -176.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -137.73 124.56 21.2 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.693 1.197 . . . . 0.0 108.363 -175.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -64.56 -25.02 67.8 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.842 0.857 . . . . 0.0 112.189 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 32.6 mtmt -74.24 -47.32 35.98 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 119.973 1.261 . . . . 0.0 108.438 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -59.84 -39.17 84.22 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.622 -0.704 . . . . 0.0 111.662 178.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -44.04 -23.19 0.08 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 130.768 3.627 . . . . 0.0 115.554 -175.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -46.42 135.79 7.94 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 126.095 1.758 . . . . 0.0 109.68 175.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -63.87 -14.06 50.21 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 121.569 -0.707 . . . . 0.0 112.653 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -57.8 -55.32 36.44 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 119.168 0.895 . . . . 0.0 110.446 -176.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.33 -26.68 60.3 Favored 'General case' 0 C--N 1.351 0.657 0 C-N-CA 115.488 -2.485 . . . . 0.0 109.383 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 69.4 mt -60.41 -46.02 95.81 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -56.79 -52.69 64.05 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.31 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 34.1 t -61.85 -41.81 98.27 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.737 0.698 . . . . 0.0 110.335 -177.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -62.95 -51.31 67.38 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 123.668 0.787 . . . . 0.0 109.749 177.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 98.0 mt -63.7 -31.5 72.69 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.289 -1.507 . . . . 0.0 111.628 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -47.98 75.66 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.515 1.526 . . . . 0.0 107.953 175.462 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 46.9 mttm -62.02 -41.59 98.25 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.821 0.848 . . . . 0.0 109.234 175.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.27 -25.42 66.86 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.818 1.647 . . . . 0.0 112.98 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 24.09 -94.14 0.01 OUTLIER Glycine 0 C--N 1.343 0.967 0 C-N-CA 128.53 2.967 . . . . 0.0 112.753 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 98.94 175.04 31.99 Favored Glycine 0 CA--C 1.521 0.445 0 C-N-CA 125.682 1.611 . . . . 0.0 112.779 175.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -103.93 108.53 19.9 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.28 1.032 . . . . 0.0 110.017 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 -156.1 100.77 2.04 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.406 1.082 . . . . 0.0 108.127 175.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -92.44 85.57 5.39 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -133.44 113.45 12.53 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 131.484 3.914 . . . . 0.0 104.914 -176.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.04 136.65 13.29 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.802 2.041 . . . . 0.0 106.438 178.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -141.96 152.92 43.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 175.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 76.38 56.04 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 -175.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.256 1.441 0 C-N-CA 126.756 2.022 . . . . 0.0 106.356 176.923 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.659 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.0 mt -81.08 77.11 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 177.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -155.51 23.79 0.4 Allowed 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.614 -1.304 . . . . 0.0 110.619 -177.111 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.24 174.74 5.84 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.997 0.919 . . . . 0.0 111.402 -175.388 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -138.35 68.57 1.39 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 126.437 1.895 . . . . 0.0 107.349 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.591 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.5 m -135.81 168.89 18.46 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 175.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -133.86 -178.31 4.96 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.556 -1.34 . . . . 0.0 112.662 -178.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.24 151.37 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 124.498 1.119 . . . . 0.0 108.933 178.024 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -93.61 77.41 4.34 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 101.881 -3.377 . . . . 0.0 101.881 174.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.77 -24.45 65.77 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.966 -1.016 . . . . 0.0 112.85 -175.161 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -70.24 -56.48 6.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 119.641 1.11 . . . . 0.0 109.128 -175.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.52 86.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.56 0.344 . . . . 0.0 110.488 176.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.1 m -64.99 -36.09 83.28 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.727 -0.608 . . . . 0.0 111.501 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -61.24 -35.0 76.04 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 117.461 -1.257 . . . . 0.0 110.092 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.55 -53.21 59.35 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 120.248 1.385 . . . . 0.0 110.541 -178.149 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.553 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -64.63 -41.02 96.44 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.752 0.706 . . . . 0.0 111.261 178.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -56.79 -39.08 73.46 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.268 1.027 . . . . 0.0 110.057 177.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -66.67 -46.32 76.05 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 126.141 1.776 . . . . 0.0 110.785 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.5 mp -58.62 -52.76 64.3 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 118.784 0.72 . . . . 0.0 112.001 175.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.487 ' CG2' HG23 ' A' ' 30' ' ' VAL . 31.5 t -63.52 -36.51 76.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 118.777 0.717 . . . . 0.0 110.603 -179.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.4 ttm-85 -63.7 -37.52 87.66 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 118.817 -0.611 . . . . 0.0 110.308 175.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -75.44 141.09 43.23 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.28 1.032 . . . . 0.0 113.189 -175.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -86.33 -11.85 50.99 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 126.448 1.899 . . . . 0.0 112.87 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -88.14 -35.8 8.67 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.0 t -54.39 138.45 39.69 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.892 1.677 . . . . 0.0 108.74 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.6 -35.52 60.52 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 175.491 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.8 t -63.08 127.22 22.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 C-N-CA 125.971 1.709 . . . . 0.0 109.99 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.5 pp -114.96 -23.83 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 126.489 1.916 . . . . 0.0 111.874 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 42.6 p-90 -126.27 148.86 49.42 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 119.577 1.08 . . . . 0.0 109.015 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.553 HG21 ' HB1' ' A' ' 16' ' ' ALA . 6.4 t -140.02 161.35 26.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 127.356 2.262 . . . . 0.0 106.682 176.215 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 17.2 p -124.07 156.73 36.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -132.5 124.7 29.02 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -110.32 176.47 5.04 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 -176.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.434 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 36.0 m-85 -123.28 136.5 54.72 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -176.661 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -148.76 124.03 10.21 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 175.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 54.95 -128.59 43.83 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 p -86.73 9.78 17.84 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.8 t -143.56 171.77 13.71 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 120.228 1.376 . . . . 0.0 114.604 -175.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.434 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 51.0 mm -90.76 137.13 22.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 101.826 -3.398 . . . . 0.0 101.826 174.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.1 m -121.83 158.95 53.17 Favored Pre-proline 0 C--O 1.236 0.376 0 C-N-CA 123.521 0.728 . . . . 0.0 110.132 176.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.19 154.61 61.82 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 121.167 1.245 . . . . 0.0 110.139 175.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.83 -171.31 15.0 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 127.295 2.379 . . . . 0.0 109.213 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -64.67 167.51 7.22 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 122.186 -0.597 . . . . 0.0 110.407 175.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -149.69 162.14 40.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.998 1.319 . . . . 0.0 109.02 -177.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.36 177.37 48.3 Favored Glycine 0 CA--C 1.524 0.615 0 CA-C-N 117.999 0.363 . . . . 0.0 112.227 -176.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.94 -7.23 17.1 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.222 1.409 . . . . 0.0 113.726 -175.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.6 137.93 45.71 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.737 1.215 . . . . 0.0 108.913 -175.577 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -84.54 -10.84 57.06 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 -175.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -61.45 -42.85 99.4 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 119.85 -1.781 . . . . 0.0 111.894 -176.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 75.4 m80 -68.96 -22.71 64.1 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.016 0.825 . . . . 0.0 111.393 178.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -61.83 -31.43 71.67 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 120.658 -1.277 . . . . 0.0 111.75 177.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.449 ' HA ' HD12 ' A' ' 123' ' ' LEU . 6.4 mm -62.03 -34.42 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -82.9 -32.64 27.21 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 117.834 -1.079 . . . . 0.0 110.099 175.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -53.82 -42.86 68.87 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 120.007 1.276 . . . . 0.0 111.081 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 76.5 m -60.89 113.42 2.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.415 ' OG1' HG22 ' A' ' 59' ' ' VAL . 2.3 p -83.62 176.93 8.65 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.466 1.506 . . . . 0.0 110.915 -176.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -72.19 -58.24 3.58 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 117.813 2.523 . . . . 0.0 117.813 -175.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -106.2 -35.51 7.17 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 117.181 2.289 . . . . 0.0 117.181 -174.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.415 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.7 m -67.77 173.37 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 123.007 1.384 . . . . 0.0 112.213 -175.328 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.8 ptt-85 -111.35 135.97 51.14 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 175.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.2 tp -134.48 162.15 33.05 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -131.99 147.23 52.44 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -139.38 126.97 21.75 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.37 0.668 . . . . 0.0 110.665 -178.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.415 ' CD1' HG13 ' A' ' 108' ' ' VAL . 37.6 t80 -95.65 123.36 39.17 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 101.933 -3.358 . . . . 0.0 101.933 175.215 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.2 t -135.09 136.17 51.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -175.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.2 ttm-85 -75.71 130.49 38.77 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.86 1.664 . . . . 0.0 106.853 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -136.28 157.92 45.66 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.251 1.02 . . . . 0.0 109.407 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.0 m -116.26 113.43 22.99 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 120.77 -1.206 . . . . 0.0 109.973 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 32.6 m -152.14 157.91 42.2 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.928 1.291 . . . . 0.0 108.403 175.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 96.34 161.93 32.79 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 125.738 1.637 . . . . 0.0 111.124 176.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.24 139.09 39.07 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 124.287 1.035 . . . . 0.0 108.717 -177.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.8 -173.8 4.32 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 129.527 3.131 . . . . 0.0 104.508 175.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 87.5 mtp -68.33 -4.34 14.13 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.592 -1.318 . . . . 0.0 110.083 175.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.7 m -136.44 168.07 20.15 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.403 2.681 . . . . 0.0 109.589 -175.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.5 mmtt -71.13 164.93 24.64 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 175.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.3 mtp180 -131.59 168.62 17.38 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 -177.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.8 t -145.4 132.93 20.82 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.162 -1.422 . . . . 0.0 107.162 175.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp -123.48 176.08 6.39 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.761 2.024 . . . . 0.0 107.49 -177.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -141.89 143.73 33.46 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 176.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -119.91 133.32 55.61 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 177.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -97.71 113.12 24.81 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 175.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mp -99.38 144.0 12.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -125.32 123.6 39.77 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 104.737 -2.32 . . . . 0.0 104.737 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.1 t-105 -100.68 131.89 46.35 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 175.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.0 mt -136.27 108.92 8.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 175.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.97 134.65 22.33 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 175.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.81 -7.01 9.42 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.179 -1.189 . . . . 0.0 113.112 -175.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -83.65 -23.63 31.72 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 120.188 -1.57 . . . . 0.0 112.96 176.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 14.2 p -85.82 123.02 39.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 120.921 1.691 . . . . 0.0 110.974 -175.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 25.3 t -146.67 124.14 11.7 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 175.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.72 -167.17 27.2 Favored Glycine 0 C--O 1.24 0.494 0 N-CA-C 107.562 -2.215 . . . . 0.0 107.562 -175.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.0 tt -53.68 -39.36 65.07 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 117.915 0.857 . . . . 0.0 109.899 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -57.03 -36.22 70.21 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.389 0.995 . . . . 0.0 111.248 -176.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.25 -49.58 27.0 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.18 -24.04 51.7 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.525 1.13 . . . . 0.0 112.844 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -50.24 -45.01 53.68 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 124.764 1.225 . . . . 0.0 109.384 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.4 m -55.09 -39.13 68.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 118.891 0.769 . . . . 0.0 110.886 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.05 -26.12 74.14 Favored Glycine 0 CA--C 1.526 0.737 0 CA-C-N 119.164 0.893 . . . . 0.0 112.717 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 99.7 m -94.48 -17.92 21.97 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.995 1.718 . . . . 0.0 111.223 177.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -104.25 -23.56 13.22 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 126.201 1.8 . . . . 0.0 115.178 -174.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -52.46 -27.86 17.85 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 120.817 1.644 . . . . 0.0 113.902 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -62.64 -43.78 97.94 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.827 1.194 . . . . 0.0 109.404 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.591 HD11 ' HB ' ' A' ' 6' ' ' THR . 18.7 mt -55.2 -65.3 0.61 Allowed 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 125.774 1.63 . . . . 0.0 110.758 -175.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.406 HG12 ' H ' ' A' ' 104' ' ' VAL 0.288 0.8 OUTLIER -58.88 -28.67 38.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.564 176.196 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.8 tttm -69.24 -35.37 76.07 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 121.017 1.735 . . . . 0.0 110.312 175.459 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -57.71 -28.91 64.27 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 120.327 1.421 . . . . 0.0 110.366 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 89.3 t -79.97 -64.44 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 175.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.415 HG13 ' CD1' ' A' ' 64' ' ' PHE . 86.8 t -67.06 25.35 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 130.069 3.348 . . . . 0.0 114.431 -175.494 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -55.35 -26.6 41.92 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 118.884 -2.385 . . . . 0.0 115.217 -175.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -92.65 83.71 4.92 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 175.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -147.03 166.14 27.74 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.119 0.485 . . . . 0.0 109.702 175.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.72 -66.49 0.92 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.922 1.289 . . . . 0.0 110.04 -175.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -145.97 176.31 9.79 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 127.903 2.481 . . . . 0.0 109.592 175.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -117.14 167.48 11.15 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.693 1.197 . . . . 0.0 110.789 177.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -146.51 148.68 32.46 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -175.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 48.2 t -126.95 127.06 69.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 175.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mp -129.44 142.56 43.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 N-CA-C 106.348 -1.723 . . . . 0.0 106.348 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 p -130.08 -0.75 4.66 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.422 ' OD1' ' HE3' ' A' ' 121' ' ' LYS . 31.4 t0 -118.78 124.14 46.53 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.227 0.921 . . . . 0.0 109.267 176.448 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -65.63 -24.33 67.02 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.802 0.841 . . . . 0.0 111.189 -176.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.422 ' HE3' ' OD1' ' A' ' 119' ' ' ASP . 24.2 mtmt -76.45 -32.5 58.45 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.087 1.355 . . . . 0.0 110.017 175.206 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.61 -35.17 45.99 Favored 'General case' 0 C--O 1.215 -0.742 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.449 HD12 ' HA ' ' A' ' 52' ' ' ILE . 3.0 tm? -44.5 -23.14 0.1 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 131.173 3.789 . . . . 0.0 114.993 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -45.64 140.35 3.41 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.616 1.966 . . . . 0.0 110.374 175.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -64.76 -14.65 59.7 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.384 -0.823 . . . . 0.0 111.981 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -54.13 -52.41 61.16 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 118.228 -0.892 . . . . 0.0 112.793 -175.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -85.72 -26.23 26.0 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 117.034 -1.866 . . . . 0.0 109.0 -176.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 47.0 mt -58.64 -48.11 86.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -54.71 -54.54 40.47 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.513 -0.756 . . . . 0.0 110.467 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 29.8 t -60.67 -39.3 87.89 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.124 0.874 . . . . 0.0 110.299 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -68.96 -45.04 71.7 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.703 -0.623 . . . . 0.0 110.752 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.4 -33.56 76.16 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.319 1.048 . . . . 0.0 111.18 176.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -66.33 -51.51 56.54 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.444 1.498 . . . . 0.0 108.164 175.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -56.08 -45.07 79.48 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.237 0.926 . . . . 0.0 109.05 175.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.01 -2.84 8.41 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.876 1.27 . . . . 0.0 114.156 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -76.26 55.5 3.21 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.215 1.388 . . . . 0.0 111.759 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -100.81 66.96 0.5 Allowed Glycine 0 CA--C 1.519 0.33 0 N-CA-C 109.915 -1.274 . . . . 0.0 109.915 178.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -144.86 113.36 6.65 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.451 1.1 . . . . 0.0 108.571 176.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -70.7 149.15 47.26 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -140.91 102.05 4.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 175.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -149.0 149.36 31.02 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 175.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.02 136.3 13.03 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 127.403 2.281 . . . . 0.0 106.665 176.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -148.5 139.6 23.18 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 175.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 4.1 m 57.65 54.05 6.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -175.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.4 mp0 . . . . . 0 C--O 1.254 1.327 0 C-N-CA 129.563 3.145 . . . . 0.0 111.865 -175.395 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.648 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.8 mp -139.58 124.47 20.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 N-CA-C 105.873 -1.899 . . . . 0.0 105.873 -173.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -143.84 83.8 1.76 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-N 118.843 0.747 . . . . 0.0 109.006 176.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.21 163.92 30.5 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 175.491 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.72 78.18 8.48 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 175.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.606 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.5 m -68.04 162.66 24.07 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 175.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -132.33 -179.35 5.38 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 120.964 -1.085 . . . . 0.0 109.282 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.47 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -139.82 150.53 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 124.795 1.238 . . . . 0.0 109.063 178.766 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -96.74 79.92 3.01 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 102.012 -3.329 . . . . 0.0 102.012 174.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -65.95 -24.24 66.77 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 117.819 -1.086 . . . . 0.0 112.953 -175.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -66.41 -56.11 12.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 176.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.83 -45.15 87.37 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 122.065 -0.397 . . . . 0.0 111.303 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.654 ' HB3' HG11 ' A' ' 107' ' ' VAL . 17.6 m -60.6 -40.37 91.55 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 118.484 -0.77 . . . . 0.0 111.224 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -62.21 -32.87 73.58 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.586 178.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.33 9.07 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 120.242 1.383 . . . . 0.0 110.014 176.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.452 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -54.45 -48.36 71.81 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.823 -0.548 . . . . 0.0 111.828 178.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -52.86 -48.59 66.96 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 124.004 0.922 . . . . 0.0 110.436 175.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.69 -43.83 98.1 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 117.1 -1.429 . . . . 0.0 110.677 -178.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.6 mp -58.01 -60.53 3.58 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 119.483 1.038 . . . . 0.0 109.534 175.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.467 ' CG2' HG23 ' A' ' 30' ' ' VAL . 43.9 t -59.74 -31.64 47.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 121.846 -0.534 . . . . 0.0 111.407 -176.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -73.33 -26.7 61.15 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.437 -0.79 . . . . 0.0 111.296 176.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -80.15 123.73 28.16 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.22 0.918 . . . . 0.0 110.025 -176.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.28 -23.0 67.15 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 123.66 0.784 . . . . 0.0 110.367 175.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.13 -3.87 88.67 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.075 1.798 . . . . 0.0 114.303 177.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.3 t -85.77 130.64 34.5 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.766 1.783 . . . . 0.0 109.608 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.6 -35.98 75.79 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 175.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 t -63.17 131.04 28.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -114.39 -23.6 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 126.034 1.733 . . . . 0.0 110.503 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.472 ' HB2' HG22 ' A' ' 65' ' ' VAL . 37.5 p-90 -131.09 141.77 50.2 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.296 1.039 . . . . 0.0 111.092 178.454 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.467 HG23 ' CG2' ' A' ' 20' ' ' VAL . 61.2 t -137.1 147.22 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 175.103 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.468 HG22 ' HB2' ' A' ' 63' ' ' ALA . 40.3 p -103.8 162.43 13.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.082 0.468 . . . . 0.0 109.83 178.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -134.32 141.82 47.05 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.768 1.627 . . . . 0.0 107.132 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -124.82 176.82 6.36 Favored 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 125.356 1.463 . . . . 0.0 107.569 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -113.9 145.05 42.04 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.456 0.646 . . . . 0.0 110.312 176.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -129.92 123.46 30.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 103.408 -2.812 . . . . 0.0 103.408 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 38.05 -94.28 0.01 OUTLIER Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.26 1.41 . . . . 0.0 113.883 -176.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.4 p -124.71 34.51 4.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.142 1.777 . . . . 0.0 112.994 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -144.71 172.86 12.41 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.321 1.048 . . . . 0.0 112.194 175.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.4 mm -98.4 132.35 43.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 C-N-CA 125.455 1.502 . . . . 0.0 107.028 176.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.5 m -120.65 160.52 43.94 Favored Pre-proline 0 C--O 1.235 0.327 0 C-N-CA 124.879 1.272 . . . . 0.0 110.251 175.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.02 160.88 44.85 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 120.971 1.114 . . . . 0.0 110.84 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -128.87 -173.11 13.33 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 106.837 -2.505 . . . . 0.0 106.837 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -69.8 171.59 8.98 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.822 -0.811 . . . . 0.0 111.212 177.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 -142.11 171.63 13.8 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.085 1.354 . . . . 0.0 111.749 -175.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.99 167.7 39.91 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-O 122.085 0.825 . . . . 0.0 112.695 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.93 -9.05 13.66 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 127.529 2.332 . . . . 0.0 112.474 -175.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.23 144.9 45.1 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 104.964 -2.235 . . . . 0.0 104.964 -177.4 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -84.06 -15.85 45.99 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -175.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -58.19 -37.22 74.35 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 120.916 1.689 . . . . 0.0 110.138 -178.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -73.38 -21.8 60.42 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.328 -0.857 . . . . 0.0 112.189 176.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -62.1 -46.47 88.91 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 120.423 1.465 . . . . 0.0 109.535 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.4 mp -61.39 -37.69 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -65.59 -39.04 91.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 122.668 0.387 . . . . 0.0 111.368 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -73.13 -24.02 60.55 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 126.543 1.937 . . . . 0.0 114.729 -175.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 85.1 m -63.67 118.12 7.8 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.289 2.3 p -82.72 163.2 21.47 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 122.662 1.22 . . . . 0.0 111.458 -175.712 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -46.6 -75.48 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 130.655 3.582 . . . . 0.0 115.949 -175.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -102.04 -36.63 8.51 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -175.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 18.5 m -62.12 166.98 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 -175.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -107.42 135.17 49.35 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 175.424 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.4 tp -132.29 170.82 14.51 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.179 1.792 . . . . 0.0 108.585 -175.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -136.33 157.03 47.77 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 124.537 1.135 . . . . 0.0 108.354 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.468 ' HB2' HG22 ' A' ' 31' ' ' THR . . . -152.67 129.71 11.09 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 119.17 0.895 . . . . 0.0 112.875 175.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -89.78 123.52 33.84 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 105.154 -2.165 . . . . 0.0 105.154 175.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.472 HG22 ' HB2' ' A' ' 29' ' ' TRP . 41.5 t -138.93 149.93 23.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 122.865 0.466 . . . . 0.0 110.61 -175.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -103.28 145.5 29.86 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.108 0.963 . . . . 0.0 110.325 175.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -136.5 149.9 48.4 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.131 1.373 . . . . 0.0 110.728 -176.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.7 m -96.06 122.95 39.44 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 87.2 m -90.17 171.59 9.4 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.442 -0.786 . . . . 0.0 109.317 -176.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.62 114.57 6.4 Favored Glycine 0 C--N 1.339 0.705 0 N-CA-C 109.036 -1.626 . . . . 0.0 109.036 175.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -70.1 169.9 12.57 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 127.31 2.244 . . . . 0.0 111.767 -175.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.57 -172.76 4.04 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 131.172 3.789 . . . . 0.0 105.597 175.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 87.0 mtp -49.42 -2.87 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 126.968 2.107 . . . . 0.0 113.895 175.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.9 m -145.77 128.25 16.0 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.45 3.5 . . . . 0.0 103.06 175.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -64.4 162.76 14.45 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -175.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 67.3 mtt180 -136.16 154.2 51.04 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 122.773 1.273 . . . . 0.0 110.732 -176.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 47.8 t -145.75 160.0 42.37 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 177.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -144.27 168.11 20.85 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 104.824 -2.287 . . . . 0.0 104.824 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -121.55 139.77 53.08 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 105.744 -1.947 . . . . 0.0 105.744 176.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -123.94 114.03 19.26 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 104.817 -2.29 . . . . 0.0 104.817 -176.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -89.09 113.29 24.42 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 102.892 -3.003 . . . . 0.0 102.892 175.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -88.59 140.35 15.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -125.96 123.18 37.95 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 102.232 -3.247 . . . . 0.0 102.232 175.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 48.2 t-105 -101.6 123.85 46.28 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 25.4 mt -142.2 78.39 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.09 149.96 11.0 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 108.792 -1.723 . . . . 0.0 108.792 175.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -68.19 -10.72 56.46 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.43 2.115 . . . . 0.0 113.001 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -83.6 -36.32 24.01 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 117.256 -1.354 . . . . 0.0 113.191 -175.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -53.21 133.92 15.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 CA-C-N 120.354 1.434 . . . . 0.0 110.049 175.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 31.4 t -58.72 156.48 10.96 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 123.209 1.481 . . . . 0.0 113.032 -175.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.64 -13.8 13.07 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 113.175 -1.83 . . . . 0.0 111.617 175.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.7 tp -72.01 -61.28 1.85 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 126.098 1.759 . . . . 0.0 110.621 175.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -68.55 -34.25 75.52 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.379 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.8 ttm180 -60.37 -42.66 96.27 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 175.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.27 -36.34 83.8 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-O 118.107 -0.949 . . . . 0.0 111.617 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -55.84 -38.38 69.99 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.945 1.248 . . . . 0.0 110.602 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 74.2 m -54.31 -34.52 61.16 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 119.739 1.154 . . . . 0.0 110.467 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.75 -25.73 70.65 Favored Glycine 0 CA--C 1.527 0.806 0 O-C-N 121.009 -1.057 . . . . 0.0 113.761 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.7 m -99.12 -13.41 19.81 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.589 1.956 . . . . 0.0 110.88 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -103.41 -24.11 13.5 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -174.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -59.73 -39.96 86.44 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 120.986 1.721 . . . . 0.0 111.149 -178.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.9 t -62.56 -31.22 71.98 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 118.611 -0.709 . . . . 0.0 110.732 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.606 HD11 ' HB ' ' A' ' 6' ' ' THR . 15.4 mt -62.81 -63.2 1.28 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 119.416 1.007 . . . . 0.0 109.573 -176.463 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.07 -30.36 47.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 117.188 -1.387 . . . . 0.0 109.455 175.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -61.91 -37.27 84.0 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 121.288 1.858 . . . . 0.0 110.288 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -60.79 -24.64 65.96 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 120.201 1.364 . . . . 0.0 111.117 179.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.654 HG11 ' HB3' ' A' ' 13' ' ' CYS . 43.7 t -86.82 -53.03 11.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 79.2 t -74.95 26.11 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 130.393 3.477 . . . . 0.0 111.427 -177.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -55.32 -26.13 38.74 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 119.618 -1.926 . . . . 0.0 112.492 -176.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -95.55 90.55 5.78 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 175.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -157.96 176.74 12.15 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.948 1.299 . . . . 0.0 108.041 179.622 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -106.31 -66.5 1.0 Allowed 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.829 -0.544 . . . . 0.0 112.013 177.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 14.0 mtpt -146.06 168.9 19.81 Favored 'General case' 0 CA--C 1.504 -0.826 0 C-N-CA 126.812 2.045 . . . . 0.0 110.017 176.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.33 179.72 4.19 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.82 -1.082 . . . . 0.0 109.553 175.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.25 140.63 23.25 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 104.256 -2.498 . . . . 0.0 104.256 -176.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.8 t -114.27 123.72 70.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -125.99 138.39 54.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 106.131 -1.803 . . . . 0.0 106.131 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.0 p -131.51 1.79 4.11 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -175.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -137.12 134.2 36.14 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.816 0.734 . . . . 0.0 109.455 177.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 17.3 ttp-105 -69.15 -28.83 66.78 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 118.195 -0.907 . . . . 0.0 112.723 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -70.42 -45.38 66.01 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 120.853 1.661 . . . . 0.0 106.623 175.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -58.37 -43.84 88.59 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 117.907 -1.044 . . . . 0.0 109.351 -176.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -44.04 -23.74 0.11 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 129.568 3.147 . . . . 0.0 115.081 -177.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -50.44 154.91 1.16 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 122.502 1.144 . . . . 0.0 114.064 175.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -61.08 -15.66 35.17 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 115.119 -0.946 . . . . 0.0 113.18 175.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -51.43 -64.95 0.65 Allowed 'General case' 0 C--O 1.242 0.689 0 CA-C-N 119.11 0.868 . . . . 0.0 111.022 176.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.92 -26.59 54.26 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 114.984 -2.686 . . . . 0.0 109.389 -175.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.7 -41.23 91.9 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 C-N-CA 123.7 0.8 . . . . 0.0 108.885 -176.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -62.1 -53.0 61.64 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 120.028 1.285 . . . . 0.0 109.929 179.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 44.0 t -65.08 -34.67 78.96 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 119.222 -0.418 . . . . 0.0 110.538 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -72.56 -44.38 62.16 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 123.902 0.881 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 65.0 mt -61.79 -31.05 71.23 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 118.342 -0.837 . . . . 0.0 108.853 175.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -69.43 -52.76 23.76 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.368 1.067 . . . . 0.0 109.298 174.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -51.34 -56.85 10.88 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.328 1.051 . . . . 0.0 109.531 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -76.15 8.14 3.55 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.528 1.931 . . . . 0.0 113.794 177.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -113.87 -48.84 0.56 Allowed Glycine 0 C--N 1.335 0.496 0 CA-C-O 118.592 -1.116 . . . . 0.0 112.741 -175.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 138.79 175.08 13.76 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -176.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.25 153.86 42.68 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.294 0.568 . . . . 0.0 109.841 176.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -151.1 81.22 1.32 Allowed 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 104.543 -2.391 . . . . 0.0 104.543 175.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -148.02 116.46 6.6 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 130.536 3.534 . . . . 0.0 101.566 -176.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -128.99 154.96 46.1 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 105.391 -2.078 . . . . 0.0 105.391 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.1 102.56 2.96 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 125.371 1.469 . . . . 0.0 107.743 -175.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -147.97 149.22 31.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 125.777 1.631 . . . . 0.0 106.681 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 86.02 35.91 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 127.959 2.504 . . . . 0.0 108.452 -175.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 . . . . . 0 C--O 1.248 1.008 0 C-N-CA 129.569 3.148 . . . . 0.0 103.547 175.877 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.907 0 N-CA-C 110.087 -1.205 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.499 HG23 ' H ' ' A' ' 3' ' ' ARG . 6.0 tp -146.89 -78.99 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.074 0.937 . . . . 0.0 110.857 173.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.499 ' H ' HG23 ' A' ' 2' ' ' ILE . 16.7 ttt180 -74.74 97.02 3.15 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.178 0.991 . . . . 0.0 109.882 -175.54 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -147.26 171.32 15.59 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -120.15 92.84 3.87 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 127.747 2.419 . . . . 0.0 107.074 176.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.4 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.4 m -119.05 170.89 8.66 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.63 1.972 . . . . 0.0 105.754 -177.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.0 tttt -139.04 176.28 8.83 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.612 -1.305 . . . . 0.0 111.247 -176.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.82 152.21 24.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 124.115 0.966 . . . . 0.0 108.961 175.577 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -100.34 78.6 2.05 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 104.678 -2.341 . . . . 0.0 104.678 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -61.89 -27.78 69.04 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.098 -0.953 . . . . 0.0 112.506 -175.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.22 -48.36 70.85 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 119.822 1.192 . . . . 0.0 110.255 177.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.16 -52.87 20.12 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.729 0.412 . . . . 0.0 110.121 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.9 m -62.31 -30.56 71.24 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.102 -0.951 . . . . 0.0 111.379 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.2 ttt180 -62.18 -35.19 78.1 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 115.946 -1.978 . . . . 0.0 109.112 175.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.87 -59.78 4.19 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 121.033 1.742 . . . . 0.0 109.906 -177.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.32 95.35 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.968 -0.458 . . . . 0.0 111.919 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -54.76 -46.31 74.34 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 175.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -58.07 -47.75 82.23 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.213 1.405 . . . . 0.0 110.102 -175.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -57.19 -62.92 1.42 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.014 0.926 . . . . 0.0 109.855 175.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.1 t -60.2 -24.95 32.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 O-C-N 121.559 -0.713 . . . . 0.0 112.244 -176.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -75.73 -31.33 59.57 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.45 1.1 . . . . 0.0 111.725 175.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.24 125.29 33.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 127.687 2.395 . . . . 0.0 112.665 -175.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.66 -19.47 58.4 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.232 1.013 . . . . 0.0 112.843 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.99 -10.09 86.42 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.015 1.293 . . . . 0.0 113.464 176.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.6 t -79.61 127.52 32.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 119.326 1.563 . . . . 0.0 109.053 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.36 -35.73 73.73 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 175.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.6 t -64.38 133.2 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 127.633 2.373 . . . . 0.0 108.571 175.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 pp -115.94 -23.66 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 126.109 1.763 . . . . 0.0 111.46 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 51.0 p-90 -123.57 147.87 46.88 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.838 0.855 . . . . 0.0 109.74 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.9 t -137.07 162.92 33.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 129.513 3.125 . . . . 0.0 107.835 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.444 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 41.3 p -125.18 159.15 32.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.61 1.164 . . . . 0.0 109.075 175.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -132.44 123.8 27.36 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -102.86 176.23 5.22 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 175.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.419 ' CE2' HD12 ' A' ' 39' ' ' ILE . 27.1 m-85 -128.53 129.41 45.98 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 -175.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -129.08 131.02 47.23 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.919 1.688 . . . . 0.0 106.487 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 45.53 -114.53 1.28 Allowed Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.114 -1.195 . . . . 0.0 110.114 -176.279 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 p -120.74 45.61 2.2 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.968 1.307 . . . . 0.0 111.208 176.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.5 t -142.93 169.42 17.6 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.419 HD12 ' CE2' ' A' ' 34' ' ' TYR . 7.7 mm -98.61 139.4 20.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 175.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.3 m -128.53 146.18 58.94 Favored Pre-proline 0 N--CA 1.469 0.491 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.289 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.14 150.22 59.44 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 121.988 1.792 . . . . 0.0 109.288 175.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -124.3 -157.57 9.8 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 125.784 1.659 . . . . 0.0 110.629 177.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -51.56 161.5 0.49 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 125.906 1.682 . . . . 0.0 112.277 176.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.4 164.95 33.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.57 1.148 . . . . 0.0 109.124 176.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.73 176.96 44.05 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 123.578 0.609 . . . . 0.0 111.751 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -107.79 -15.61 14.52 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.355 1.462 . . . . 0.0 113.533 -176.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -123.63 142.63 50.86 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 -176.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -83.36 -8.91 59.33 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.799 1.036 . . . . 0.0 113.799 -174.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -54.1 -36.85 63.64 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.846 1.203 . . . . 0.0 110.137 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -62.68 -28.81 70.19 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.044 1.337 . . . . 0.0 112.158 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.424 ' CD1' HD11 ' A' ' 123' ' ' LEU . 0.7 OUTLIER -63.52 -52.45 61.16 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -178.966 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.52 -36.78 76.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -176.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -60.83 -31.88 71.29 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.67 0.788 . . . . 0.0 112.102 175.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -85.67 -24.04 27.19 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.008 0.923 . . . . 0.0 113.455 -175.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 96.6 m -59.85 120.75 10.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.602 1.092 . . . . 0.0 112.539 -175.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 2.4 p -104.92 -173.53 2.32 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 127.181 2.192 . . . . 0.0 113.898 -178.219 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -73.67 -75.93 0.14 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 129.619 3.168 . . . . 0.0 117.964 -175.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -102.35 -24.76 13.83 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.051 1.74 . . . . 0.0 115.353 -174.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.7 m -63.94 158.78 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 CA-C-O 122.816 1.293 . . . . 0.0 112.37 -175.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.3 ptt-85 -108.41 130.65 55.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 102.894 -3.002 . . . . 0.0 102.894 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 31.8 tp -140.7 156.09 46.3 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -175.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -131.38 148.72 52.69 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.444 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.94 129.16 16.69 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.344 0.658 . . . . 0.0 111.629 -179.075 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.424 ' CE1' HG13 ' A' ' 108' ' ' VAL . 33.0 t80 -96.44 123.64 40.16 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 175.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.3 t -134.39 141.4 43.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 123.426 0.69 . . . . 0.0 109.304 -175.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -85.06 137.84 32.8 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 175.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -131.49 168.22 18.01 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 127.648 2.379 . . . . 0.0 106.622 -176.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.3 m -130.48 143.81 51.0 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 121.069 -1.02 . . . . 0.0 108.739 -177.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 3.6 m -83.48 160.76 21.45 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 120.839 -1.163 . . . . 0.0 108.018 175.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -54.08 135.18 43.93 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 108.691 -1.764 . . . . 0.0 108.691 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -46.49 136.64 7.32 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 128.269 2.628 . . . . 0.0 112.491 -175.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -138.98 179.75 6.31 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.135 1.774 . . . . 0.0 109.096 176.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 23.9 mmt -61.78 -5.71 2.18 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.832 1.253 . . . . 0.0 113.532 179.279 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.4 m -146.09 136.59 24.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.059 1.743 . . . . 0.0 106.547 175.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -46.16 152.84 0.37 Allowed 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.35 1.86 . . . . 0.0 113.254 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 -121.21 148.32 44.42 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 123.638 0.775 . . . . 0.0 109.881 -176.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.6 t -146.89 137.82 23.92 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.658 1.583 . . . . 0.0 109.168 175.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.442 ' HA ' ' HE2' ' A' ' 78' ' ' LYS . 4.4 mmpt? -145.99 176.04 10.0 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 127.998 2.519 . . . . 0.0 108.115 175.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -141.56 146.36 36.23 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 176.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -125.47 122.44 36.65 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 176.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -97.65 113.33 25.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 100.421 -3.918 . . . . 0.0 100.421 174.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.9 mp -97.36 144.71 10.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -123.62 123.36 40.4 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 103.258 -2.867 . . . . 0.0 103.258 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -96.04 123.48 39.66 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 103.716 -2.698 . . . . 0.0 103.716 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.652 HD11 HG21 ' A' ' 97' ' ' THR . 12.3 mt -144.91 97.77 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 104.134 -2.543 . . . . 0.0 104.134 178.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.62 166.02 4.75 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-O 121.717 0.621 . . . . 0.0 113.07 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -75.78 -19.23 59.15 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.213 -1.757 . . . . 0.0 110.009 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -82.72 -20.71 35.49 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 120.812 -1.18 . . . . 0.0 113.486 -175.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . 0.257 0.8 OUTLIER -66.33 140.16 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 119.852 1.205 . . . . 0.0 113.373 -177.777 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 47.7 t -70.88 144.59 50.62 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 126.136 1.774 . . . . 0.0 109.89 179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -60.51 -21.16 57.11 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-O 119.179 -0.79 . . . . 0.0 113.205 179.46 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 tt -65.06 -32.58 74.36 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.872 1.336 . . . . 0.0 110.062 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -80.09 -44.07 20.66 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 175.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.8 ttp85 -58.62 -25.03 62.24 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.514 1.052 . . . . 0.0 111.298 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.34 70.57 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 120.849 -1.157 . . . . 0.0 111.861 175.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -64.99 -39.12 92.99 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-O 118.032 -0.985 . . . . 0.0 108.764 175.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.652 HG21 HD11 ' A' ' 85' ' ' ILE . 2.5 m -54.26 -34.81 61.64 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.383 0.673 . . . . 0.0 110.137 179.132 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.67 -12.37 56.37 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 125.135 1.35 . . . . 0.0 114.805 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.6 m -125.45 2.7 7.68 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.784 2.034 . . . . 0.0 110.603 175.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -103.62 -42.93 5.51 Favored 'General case' 0 C--O 1.226 -0.157 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -177.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.564 ' HE2' ' HG3' ' A' ' 114' ' ' GLU . 9.3 mtpm? -59.59 -28.81 67.49 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.52 -1.363 . . . . 0.0 112.44 -176.241 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.5 t -68.14 -47.01 69.23 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.458 1.503 . . . . 0.0 108.855 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.4 HD11 ' HB ' ' A' ' 6' ' ' THR . 14.5 mt -59.44 -58.04 10.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.855 1.662 . . . . 0.0 109.987 -176.127 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.4 p -62.21 -30.93 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-O 117.27 -1.347 . . . . 0.0 109.667 176.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.82 -31.16 72.24 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 121.178 1.808 . . . . 0.0 110.893 176.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -63.57 -25.73 68.37 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 120.154 1.343 . . . . 0.0 111.099 176.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 57.5 t -86.19 -56.97 4.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 175.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.424 HG13 ' CE1' ' A' ' 64' ' ' PHE . 86.3 t -73.01 26.65 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 131.106 3.762 . . . . 0.0 112.127 -175.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -52.76 -21.63 4.34 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 119.679 -1.888 . . . . 0.0 113.717 -176.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -99.02 84.39 3.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 174.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -147.42 170.11 18.07 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 175.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 -66.32 0.91 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -176.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -152.85 169.26 23.25 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 127.12 2.168 . . . . 0.0 108.159 175.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.564 ' HG3' ' HE2' ' A' ' 101' ' ' LYS . 0.7 OUTLIER -107.19 167.77 9.68 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 175.193 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -137.6 152.17 49.11 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 -175.052 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.8 t -121.24 124.87 72.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 175.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mp -124.94 141.47 44.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 176.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.2 p -130.89 6.46 4.65 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.304 1.442 . . . . 0.0 112.827 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -139.81 128.87 23.65 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.573 0.624 . . . . 0.0 111.305 175.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 -64.99 -32.87 74.8 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 124.778 1.231 . . . . 0.0 113.966 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.696 ' HE3' ' H ' ' A' ' 121' ' ' LYS . 0.3 OUTLIER -76.21 -41.04 50.69 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 120.98 1.718 . . . . 0.0 109.667 176.622 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.9 -37.42 86.88 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.022 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.424 HD11 ' CD1' ' A' ' 51' ' ' PHE . 2.4 tm? -45.0 -23.65 0.16 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 129.382 3.073 . . . . 0.0 115.076 -176.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -44.41 140.19 2.4 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.74 1.216 . . . . 0.0 110.856 175.559 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.29 -14.56 2.94 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -54.01 -55.6 25.78 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 124.345 1.058 . . . . 0.0 111.97 177.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.42 -25.7 35.96 Favored 'General case' 0 C--N 1.352 0.682 0 C-N-CA 116.614 -2.035 . . . . 0.0 108.713 -177.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 64.8 mt -60.74 -49.04 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -55.61 -51.33 67.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.266 0.626 . . . . 0.0 109.878 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.0 t -63.88 -38.55 91.5 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.454 0.702 . . . . 0.0 111.007 -176.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -67.91 -40.29 83.46 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.838 1.255 . . . . 0.0 109.688 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 96.7 mt -72.82 -24.69 60.94 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.07 -1.018 . . . . 0.0 110.339 175.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.6 mtpt -73.78 -47.29 39.97 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 125.185 1.394 . . . . 0.0 108.403 175.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -54.01 -65.41 0.57 Allowed 'General case' 0 C--O 1.234 0.251 0 C-N-CA 126.247 1.819 . . . . 0.0 108.508 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.61 -13.34 41.22 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 176.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -65.03 -18.7 64.99 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 125.267 1.413 . . . . 0.0 111.847 176.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -76.16 97.49 1.16 Allowed Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 104.047 -3.621 . . . . 0.0 104.047 175.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.28 99.91 0.15 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.596 0.758 . . . . 0.0 110.064 -176.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -128.69 79.95 1.94 Allowed 'General case' 0 C--O 1.235 0.322 0 N-CA-C 103.709 -2.7 . . . . 0.0 103.709 175.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -139.47 90.74 2.43 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.93 150.04 45.91 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 125.418 1.487 . . . . 0.0 109.392 175.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.22 123.25 5.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 126.36 1.864 . . . . 0.0 106.559 175.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 96.6 mm-40 -115.45 168.4 10.02 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 175.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.7 m 54.69 43.06 30.73 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 122.005 0.907 . . . . 0.0 108.852 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 . . . . . 0 C--O 1.249 1.036 0 O-C-N 120.942 -1.099 . . . . 0.0 110.024 176.945 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.773 0 N-CA-C 109.901 -1.28 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 42.2 mm -54.07 123.2 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 C-N-CA 124.264 1.026 . . . . 0.0 110.397 -171.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 76.7 mtt85 -95.54 123.29 39.02 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 10.5 tpt -155.6 171.97 19.06 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -176.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.69 63.27 5.89 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 m -71.01 149.29 46.77 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.163 2.185 . . . . 0.0 106.283 175.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.6 mtmt -132.02 179.97 5.77 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.091 0.956 . . . . 0.0 109.413 -176.306 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.581 HG22 HG12 ' A' ' 39' ' ' ILE . 0.2 OUTLIER -121.25 153.67 24.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 C-N-CA 124.129 0.971 . . . . 0.0 110.189 176.188 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -91.57 80.57 5.39 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 103.682 -2.71 . . . . 0.0 103.682 175.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -62.88 -27.4 69.33 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 117.383 -1.294 . . . . 0.0 111.94 -175.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -72.33 -53.9 11.05 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 119.64 1.109 . . . . 0.0 109.236 178.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.39 -43.82 96.47 Favored 'General case' 0 CA--C 1.527 0.069 0 CA-C-N 118.342 0.519 . . . . 0.0 111.064 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 81.2 m -70.27 -30.6 67.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.373 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -61.15 -34.54 75.18 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-O 116.834 -1.555 . . . . 0.0 109.853 176.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.28 -57.73 10.08 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 119.753 1.161 . . . . 0.0 110.157 -177.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.49 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -66.86 -41.94 86.5 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.208 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -52.7 -40.13 62.67 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 123.312 0.645 . . . . 0.0 111.104 175.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -63.21 -45.06 93.46 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.81 0.844 . . . . 0.0 110.574 -176.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.53 -50.68 72.57 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 123.853 0.861 . . . . 0.0 110.605 175.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.6 t -65.99 -30.52 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-O 119.49 -0.29 . . . . 0.0 111.218 -178.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.455 ' CZ ' ' HA ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -66.5 -48.84 68.54 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 118.077 -0.964 . . . . 0.0 108.725 175.764 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.455 ' HA ' ' CZ ' ' A' ' 21' ' ' ARG . 7.5 t70 -62.16 140.53 58.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 123.981 0.801 . . . . 0.0 112.289 -175.472 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -78.75 -19.51 52.13 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 117.566 -1.207 . . . . 0.0 113.691 -175.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -105.99 -1.66 39.14 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 118.846 -0.975 . . . . 0.0 114.096 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 t -71.74 147.95 46.85 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.365 1.582 . . . . 0.0 109.133 176.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.88 -33.11 59.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.328 176.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.7 t -74.79 123.48 30.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 175.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.2 pp -114.64 -23.89 4.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 C-N-CA 124.289 1.035 . . . . 0.0 110.874 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.405 ' CZ2' ' HA3' ' A' ' 45' ' ' GLY . 34.3 p-90 -124.64 144.98 49.89 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.632 0.773 . . . . 0.0 109.194 178.517 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.49 HG21 ' HB1' ' A' ' 16' ' ' ALA . 5.8 t -135.68 161.93 37.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 127.113 2.165 . . . . 0.0 107.594 176.521 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 72.3 p -125.55 157.83 36.1 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 175.385 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -127.5 123.71 36.57 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 176.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -94.46 176.01 6.46 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.44 ' CE2' HD12 ' A' ' 39' ' ' ILE . 21.7 m-85 -119.65 137.5 53.84 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 175.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -137.47 123.97 20.86 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 50.67 -110.88 1.03 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.5 p -110.71 27.39 9.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.648 1.579 . . . . 0.0 112.56 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -148.07 172.6 14.01 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 119.25 0.932 . . . . 0.0 113.143 176.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.581 HG12 HG22 ' A' ' 8' ' ' ILE . 7.8 mm -99.0 134.19 38.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 105.063 -2.199 . . . . 0.0 105.063 175.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.1 m -127.66 159.62 65.08 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 123.186 0.594 . . . . 0.0 111.262 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.99 144.19 57.27 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 121.809 1.673 . . . . 0.0 110.428 175.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -113.83 -155.05 11.4 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 125.827 1.679 . . . . 0.0 110.078 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -63.56 159.61 18.38 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.688 1.195 . . . . 0.0 110.808 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -143.96 165.97 26.27 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 125.523 1.529 . . . . 0.0 109.043 176.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.405 ' HA3' ' CZ2' ' A' ' 29' ' ' TRP . . . -178.51 -175.65 45.78 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 124.016 0.817 . . . . 0.0 111.818 -176.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -118.39 -22.7 7.51 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.215 1.406 . . . . 0.0 112.465 -176.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -115.07 130.5 56.95 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 -176.183 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -83.04 -7.57 59.64 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.042 0.837 . . . . 0.0 111.456 -175.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -54.23 -37.16 64.3 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.283 -1.511 . . . . 0.0 111.69 175.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -70.11 -26.86 64.16 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.829 1.252 . . . . 0.0 112.444 177.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -62.49 -46.61 87.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.472 1.509 . . . . 0.0 109.477 -177.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 mp -61.12 -42.07 91.8 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -177.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -65.57 -24.01 66.98 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.369 0.531 . . . . 0.0 112.425 176.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -80.93 -23.9 38.56 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.842 1.201 . . . . 0.0 112.251 176.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 99.1 m -60.16 123.56 17.54 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 104.284 -2.488 . . . . 0.0 104.284 175.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.509 ' OG1' HG22 ' A' ' 59' ' ' VAL . 72.7 p -82.84 174.04 11.3 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -174.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -60.76 -76.55 0.05 OUTLIER 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.433 2.293 . . . . 0.0 109.424 176.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -106.4 -36.53 6.79 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -175.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.509 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -60.62 165.7 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.293 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -174.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 28.1 ptt-85 -103.77 151.62 22.83 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 175.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.8 tp -148.65 161.53 41.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -127.16 151.07 49.16 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.481 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.58 157.87 43.92 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.088 0.555 . . . . 0.0 111.842 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.419 ' CE1' HG13 ' A' ' 108' ' ' VAL . 34.0 t80 -131.37 123.78 28.95 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 -178.148 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 39.6 t -137.67 141.63 38.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -175.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.2 ttp-105 -83.99 138.31 33.18 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 175.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -136.13 153.58 51.25 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 125.474 1.509 . . . . 0.0 107.837 -177.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 92.3 m -123.01 113.31 18.89 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 121.124 -0.985 . . . . 0.0 109.122 -179.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.8 m -156.67 141.11 16.7 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.46 113.65 0.06 OUTLIER Glycine 0 CA--C 1.507 -0.417 0 N-CA-C 106.189 -2.764 . . . . 0.0 106.189 -175.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -123.9 176.27 6.42 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 126.015 1.726 . . . . 0.0 111.643 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -141.98 -173.1 3.72 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 129.398 3.079 . . . . 0.0 106.304 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -55.88 0.46 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.467 1.507 . . . . 0.0 113.559 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 66.5 m -146.4 152.65 39.41 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 128.622 2.769 . . . . 0.0 105.4 175.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -61.32 155.4 21.36 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.583 0.706 . . . . 0.0 109.847 -177.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 46.6 mtp180 -133.55 176.32 8.65 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 126.044 1.738 . . . . 0.0 109.351 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 8.5 t -142.35 160.17 40.79 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 124.473 1.109 . . . . 0.0 110.109 -176.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -145.06 171.57 14.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 130.852 3.661 . . . . 0.0 106.608 176.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -143.18 143.44 31.78 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 175.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.57 118.3 31.77 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 178.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -87.88 113.7 23.79 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 101.988 -3.338 . . . . 0.0 101.988 175.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.6 mp -101.31 143.14 14.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 -176.036 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -125.69 123.58 39.23 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 175.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -93.37 123.72 36.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 104.868 -2.271 . . . . 0.0 104.868 175.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.8 mt -143.12 92.29 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -58.93 156.11 24.84 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 108.308 -1.917 . . . . 0.0 108.308 175.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -74.33 -4.43 36.25 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 119.997 -1.884 . . . . 0.0 111.084 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -83.83 -36.4 23.52 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 121.254 -0.904 . . . . 0.0 110.771 -175.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.5 p -64.45 128.99 27.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 175.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.4 t -60.5 154.33 21.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.527 1.156 . . . . 0.0 111.745 -175.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -53.67 -30.84 44.19 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 125.59 1.567 . . . . 0.0 113.179 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.6 tt -62.97 -41.44 99.55 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.489 1.116 . . . . 0.0 111.12 178.442 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -76.92 -41.24 44.29 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.45 -35.0 62.53 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.64 1.109 . . . . 0.0 109.806 175.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.37 -30.25 64.72 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 119.877 1.217 . . . . 0.0 113.412 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 23.7 mmtp -57.88 -31.91 67.17 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 119.384 0.993 . . . . 0.0 110.833 175.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.5 m -56.65 -33.98 66.87 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.493 1.042 . . . . 0.0 109.933 -178.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.23 -14.97 67.14 Favored Glycine 0 CA--C 1.535 1.324 0 CA-C-O 119.143 -0.81 . . . . 0.0 113.834 177.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.8 m -112.32 -4.62 14.27 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.684 2.394 . . . . 0.0 110.245 176.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -104.48 -35.36 7.92 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 124.257 1.023 . . . . 0.0 111.532 -175.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -59.6 -34.71 73.09 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.108 -0.995 . . . . 0.0 111.058 -177.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 7.0 t -66.98 -33.87 76.52 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.804 1.241 . . . . 0.0 110.369 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.538 ' O ' HG21 ' A' ' 8' ' ' ILE . 13.2 mt -70.91 -63.29 1.13 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.687 1.195 . . . . 0.0 108.88 -176.629 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.267 0.9 OUTLIER -59.46 -25.2 30.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-O 117.909 -1.043 . . . . 0.0 109.537 175.562 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -61.8 -41.97 98.42 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 120.909 1.686 . . . . 0.0 108.818 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -51.03 -31.03 17.08 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 120.704 1.593 . . . . 0.0 111.75 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 96.4 t -85.32 -63.57 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 124.685 1.194 . . . . 0.0 108.096 175.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.419 HG13 ' CE1' ' A' ' 64' ' ' PHE . 45.0 t -71.14 26.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 C-N-CA 130.566 3.546 . . . . 0.0 112.824 -175.679 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -57.63 -26.96 62.35 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.776 -1.828 . . . . 0.0 113.525 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -91.56 79.87 5.45 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 175.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -144.0 165.05 28.84 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 123.225 0.61 . . . . 0.0 109.569 177.725 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.63 -66.63 0.89 Allowed 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.36 175.72 12.8 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 126.451 1.901 . . . . 0.0 109.176 -175.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -115.41 164.51 14.17 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 123.429 0.456 . . . . 0.0 110.67 175.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -139.95 142.22 36.39 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 102.659 -3.089 . . . . 0.0 102.659 -175.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.34 128.5 73.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 176.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -128.25 145.14 35.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 125.985 1.714 . . . . 0.0 106.796 -176.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 42.0 p -131.31 -7.07 3.79 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.558 1.143 . . . . 0.0 113.464 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -116.73 130.08 56.51 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 15.2 ttp-105 -72.88 -28.54 62.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 118.61 -0.71 . . . . 0.0 111.964 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -69.89 -45.79 66.88 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 119.503 1.047 . . . . 0.0 109.017 175.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -53.55 -47.36 70.09 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 124.434 1.094 . . . . 0.0 110.16 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -43.91 -24.11 0.12 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 128.483 2.713 . . . . 0.0 116.793 -175.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -44.6 143.38 1.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 124.097 0.959 . . . . 0.0 110.636 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -60.33 -21.19 61.75 Favored 'General case' 0 C--N 1.341 0.213 0 O-C-N 121.587 -0.695 . . . . 0.0 111.024 -178.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -46.1 -59.17 3.03 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 125.34 1.456 . . . . 0.0 112.308 -175.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -81.15 -26.33 36.17 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 115.933 -2.307 . . . . 0.0 109.274 -176.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 36.2 mt -57.83 -44.07 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -60.34 -50.22 74.49 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 123.54 0.736 . . . . 0.0 111.64 -175.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -75.7 -30.68 59.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.554 0.616 . . . . 0.0 111.368 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.09 -46.46 81.02 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.044 -1.035 . . . . 0.0 108.922 176.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.64 -26.16 67.69 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.084 0.954 . . . . 0.0 111.648 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -63.59 -60.54 3.2 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 175.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? -53.82 -57.36 11.19 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 123.652 0.595 . . . . 0.0 110.474 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.21 -24.72 66.54 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -176.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.82 -2.96 83.81 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.743 1.639 . . . . 0.0 113.677 177.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 106.89 -5.43 36.73 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 125.595 1.569 . . . . 0.0 114.337 175.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -85.37 86.01 7.4 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 119.69 1.745 . . . . 0.0 108.03 176.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -144.49 107.4 4.49 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 105.683 -1.969 . . . . 0.0 105.683 176.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -142.71 116.23 9.12 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 -175.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -116.57 117.28 29.44 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 104.637 -2.357 . . . . 0.0 104.637 175.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -147.12 136.05 22.28 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 127.435 2.294 . . . . 0.0 105.18 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -144.65 140.5 28.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 -175.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 86.3 55.88 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 128.207 2.603 . . . . 0.0 109.66 -178.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 . . . . . 0 C--O 1.249 1.076 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 175.575 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 122.614 1.197 . . . . 0.0 108.105 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.6 m -83.72 172.64 12.05 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.417 2.287 . . . . 0.0 107.538 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.503 ' HG3' ' H ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -150.14 -177.12 5.74 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 119.908 -1.745 . . . . 0.0 111.298 -175.407 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.503 ' H ' ' HG3' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -142.8 146.75 21.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 C-N-CA 127.312 2.245 . . . . 0.0 105.384 175.073 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -92.07 83.42 5.13 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 102.167 -3.271 . . . . 0.0 102.167 174.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.9 pttt -58.22 -33.48 69.37 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-O 117.167 -1.397 . . . . 0.0 113.064 -175.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -78.03 -44.26 27.0 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 120.354 1.434 . . . . 0.0 110.353 -176.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.8 -40.06 94.61 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 119.249 0.932 . . . . 0.0 110.537 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 62.0 m -72.45 -34.8 68.01 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.45 -0.781 . . . . 0.0 110.625 178.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.98 -35.97 74.1 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.904 175.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.14 -54.15 49.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 119.071 0.851 . . . . 0.0 109.997 -176.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.41 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -67.46 -40.96 85.35 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.665 0.666 . . . . 0.0 111.297 177.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -50.62 -47.89 58.18 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.264 0.626 . . . . 0.0 110.781 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -54.66 -41.04 69.67 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.899 1.28 . . . . 0.0 111.636 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 mp -68.81 -61.52 1.77 Allowed 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 124.183 0.993 . . . . 0.0 110.697 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.3 t -55.83 -31.55 30.19 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.783 -175.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -29.98 67.83 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.617 1.099 . . . . 0.0 111.916 175.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -85.6 125.84 33.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.665 1.121 . . . . 0.0 112.546 -175.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -61.79 -15.8 44.5 Favored 'General case' 0 C--N 1.344 0.346 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 175.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.91 -9.37 57.35 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 125.286 1.422 . . . . 0.0 112.61 176.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.0 t -66.8 127.08 31.11 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 120.338 2.069 . . . . 0.0 108.162 175.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.8 -32.73 73.97 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.7 t -72.57 123.69 27.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 104.424 -2.436 . . . . 0.0 104.424 175.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -113.29 -25.27 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 C-N-CA 123.33 0.652 . . . . 0.0 109.974 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 24.7 p-90 -126.03 145.87 50.13 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 121.838 0.828 . . . . 0.0 109.418 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.41 HG21 ' HB1' ' A' ' 16' ' ' ALA . 6.0 t -138.33 159.97 31.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 127.664 2.386 . . . . 0.0 106.024 175.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 35.4 p -120.2 153.54 36.12 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 175.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -122.3 123.7 42.03 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 104.805 -2.295 . . . . 0.0 104.805 175.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 41.6 mmtt -102.37 176.46 5.17 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.538 1.935 . . . . 0.0 105.999 -177.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -126.44 152.32 46.56 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 175.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -146.63 163.92 34.3 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 125.888 1.675 . . . . 0.0 107.564 175.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 24.36 -88.18 0.01 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 128.51 2.957 . . . . 0.0 115.311 178.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 27.0 p -136.12 26.74 3.23 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.726 1.211 . . . . 0.0 110.154 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -142.53 157.24 44.94 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -175.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 1.8 mp -84.99 142.95 12.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 N-CA-C 103.935 -2.617 . . . . 0.0 103.935 175.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.46 161.72 57.34 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 125.398 1.479 . . . . 0.0 110.206 -177.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -71.41 152.89 61.02 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 121.572 1.515 . . . . 0.0 110.169 175.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -120.86 -152.37 8.82 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 126.103 1.811 . . . . 0.0 109.767 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.19 163.11 10.74 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.243 1.417 . . . . 0.0 110.458 175.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -141.77 161.19 38.56 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 126.455 1.902 . . . . 0.0 109.429 177.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -176.09 -179.66 46.68 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-O 121.981 0.767 . . . . 0.0 112.623 177.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.6 -13.93 9.13 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.433 1.493 . . . . 0.0 112.534 -176.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -120.73 130.98 54.28 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.524 1.13 . . . . 0.0 107.958 -175.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -83.48 -13.08 55.45 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -175.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -57.81 -43.48 85.75 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 119.776 -1.827 . . . . 0.0 109.635 175.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -68.85 -21.93 64.25 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 119.048 -0.501 . . . . 0.0 111.585 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -61.45 -43.86 98.12 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 120.373 1.442 . . . . 0.0 107.9 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.3 mm -56.71 -47.27 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 123.475 0.71 . . . . 0.0 109.268 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -61.2 -40.25 93.27 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.527 0.731 . . . . 0.0 111.315 -177.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -69.87 -23.33 63.24 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 125.528 1.531 . . . . 0.0 113.894 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.5 m -65.23 113.55 4.08 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 176.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.301 2.1 p -91.07 -174.43 3.98 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.039 2.135 . . . . 0.0 111.746 -176.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -81.26 -75.95 0.26 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -175.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -95.19 -25.41 16.4 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 -175.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 8.4 m -63.72 149.2 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 O-C-N 120.706 -1.246 . . . . 0.0 108.569 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -103.28 129.44 50.28 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 103.174 -2.899 . . . . 0.0 103.174 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.3 tp -130.0 160.59 33.19 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -130.82 153.34 49.19 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 175.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.473 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -138.8 158.73 43.68 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.466 0.65 . . . . 0.0 110.338 175.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -129.64 123.48 31.33 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 103.88 -2.637 . . . . 0.0 103.88 177.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.3 t -134.53 135.34 53.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -175.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 59.5 ttp85 -80.64 123.63 28.31 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 104.883 -2.266 . . . . 0.0 104.883 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -135.26 123.83 23.57 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.278 1.037 . . . . 0.0 110.248 -175.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 26.8 m . . . . . 0 C--N 1.317 -0.816 0 C-N-CA 124.364 1.066 . . . . 0.0 111.589 -175.527 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.5 m . . . . . 0 N--CA 1.448 -0.543 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -63.21 157.81 21.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.327 0.585 . . . . 0.0 110.706 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.1 mtt-85 -141.86 155.54 45.54 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 105.05 -2.204 . . . . 0.0 105.05 175.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 t -144.25 160.85 40.29 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.4 mtpt -145.81 176.47 9.64 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 126.395 1.878 . . . . 0.0 108.795 -175.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -135.68 140.4 44.44 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -121.19 117.82 28.09 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.965 1.706 . . . . 0.0 107.222 -176.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -87.97 113.58 23.76 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 105.091 -2.188 . . . . 0.0 105.091 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.7 mt -104.4 143.2 16.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 -176.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -123.94 123.71 41.01 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 175.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -96.49 123.75 40.26 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 125.766 1.626 . . . . 0.0 106.731 175.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.4 mt -143.4 97.38 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 176.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -60.64 169.73 8.26 Favored Glycine 0 CA--C 1.537 1.431 0 CA-C-N 119.816 1.189 . . . . 0.0 112.101 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -76.96 -12.39 59.94 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 119.991 -1.888 . . . . 0.0 109.978 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -83.15 -29.69 28.45 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 120.207 -1.558 . . . . 0.0 112.511 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.7 125.35 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 CA-C-O 121.586 0.708 . . . . 0.0 111.831 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 18.9 t -64.85 150.27 47.97 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 124.529 1.131 . . . . 0.0 110.681 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.45 -28.01 58.94 Favored Glycine 0 CA--C 1.521 0.448 0 C-N-CA 125.339 1.447 . . . . 0.0 113.913 -178.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.6 tt -59.2 -37.35 77.24 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.116 1.458 . . . . 0.0 110.241 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -73.76 -43.82 57.91 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 121.266 -0.896 . . . . 0.0 109.073 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -57.27 -28.93 63.42 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.847 -0.597 . . . . 0.0 110.359 177.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.74 -44.38 97.01 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 119.599 1.091 . . . . 0.0 109.703 176.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.07 -54.98 40.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 118.014 -0.994 . . . . 0.0 108.331 175.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 59.7 m -50.58 -39.63 50.18 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.925 0.89 . . . . 0.0 110.112 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.04 -26.4 74.03 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 118.562 -1.132 . . . . 0.0 113.745 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.1 m -105.07 -0.41 26.72 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.627 1.571 . . . . 0.0 110.981 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -103.96 -24.16 13.27 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 124.809 1.244 . . . . 0.0 110.084 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -52.57 -37.96 58.99 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 119.883 1.22 . . . . 0.0 111.5 175.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.1 t -56.82 -41.68 78.25 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.067 0.849 . . . . 0.0 110.393 175.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 28.4 mt -64.18 -64.74 0.8 Allowed 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 125.871 1.668 . . . . 0.0 109.685 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -57.51 -30.76 37.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 117.852 -1.071 . . . . 0.0 110.257 175.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -65.42 -31.35 72.41 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 120.739 1.609 . . . . 0.0 110.468 176.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -63.52 -23.8 67.55 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 121.112 1.778 . . . . 0.0 111.966 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 81.1 t -85.55 -53.82 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 175.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 53.7 t -78.28 25.9 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 128.012 2.525 . . . . 0.0 111.993 -175.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -58.07 -25.65 61.53 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 120.031 -1.668 . . . . 0.0 109.864 175.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.01 67.8 4.8 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.298 1.839 . . . . 0.0 106.688 175.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.12 174.53 11.23 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 121.157 -0.964 . . . . 0.0 111.778 179.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -110.27 -47.63 3.27 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.761 0.825 . . . . 0.0 110.868 -176.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.2 mptt -158.7 174.68 14.67 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 128.414 2.686 . . . . 0.0 107.486 175.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -120.19 163.19 18.11 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.081 1.752 . . . . 0.0 109.661 176.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -140.54 156.64 46.25 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 103.744 -2.688 . . . . 0.0 103.744 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.8 t -132.58 127.97 57.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.5 mp -134.07 145.86 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 125.958 1.703 . . . . 0.0 109.21 -175.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 78.3 p -138.9 -5.9 1.48 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 126.664 1.985 . . . . 0.0 114.032 -175.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -141.54 153.94 45.17 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 119.227 0.921 . . . . 0.0 109.542 -176.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -37.94 89.22 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.954 -1.092 . . . . 0.0 111.523 -178.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 8.0 mttp -66.05 -31.14 71.85 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 124.745 1.218 . . . . 0.0 110.315 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -77.37 -23.39 50.81 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.448 1.899 . . . . 0.0 110.208 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -82.9 -23.13 33.69 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 127.025 2.13 . . . . 0.0 112.658 -178.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -57.9 123.47 15.92 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.183 0.901 . . . . 0.0 111.728 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.8 -23.98 55.09 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 115.639 1.718 . . . . 0.0 115.639 177.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -61.12 -55.61 30.49 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -174.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -74.58 -26.26 59.81 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 117.632 -1.627 . . . . 0.0 109.662 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 54.0 mt -56.86 -34.66 44.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 124.652 1.181 . . . . 0.0 109.144 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 38.9 mttt -55.79 -55.4 32.86 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 120.172 1.351 . . . . 0.0 110.063 175.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 5.2 t -67.98 -34.91 77.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.501 0.32 . . . . 0.0 110.507 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -63.63 -42.42 98.15 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.227 -0.921 . . . . 0.0 109.236 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 56.4 mt -69.95 -23.52 63.2 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.167 1.387 . . . . 0.0 111.45 175.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -74.89 -51.02 14.93 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 174.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -53.24 -56.73 14.16 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.025 1.33 . . . . 0.0 109.765 175.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.341 0 C-N-CA 123.892 0.877 . . . . 0.0 112.656 178.155 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.48 0 CA-C-O 121.298 0.57 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.828 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.5 m -66.99 165.59 15.31 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 175.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -123.93 -176.13 3.4 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.526 -1.359 . . . . 0.0 111.327 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -143.64 156.62 16.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 124.002 0.921 . . . . 0.0 110.45 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -100.79 85.74 2.95 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 102.587 -3.116 . . . . 0.0 102.587 174.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -65.46 -32.26 73.78 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 117.927 -1.035 . . . . 0.0 111.962 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -67.76 -50.49 56.85 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.847 1.203 . . . . 0.0 109.815 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.03 -45.9 76.06 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -177.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.7 m -72.31 -30.86 65.18 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 118.754 -0.641 . . . . 0.0 111.297 -177.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 51.1 ttm-85 -67.34 -31.99 72.62 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 116.952 -1.499 . . . . 0.0 108.84 175.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.09 -60.0 3.99 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 120.494 1.497 . . . . 0.0 109.744 -178.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.98 -38.86 89.61 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.171 0.442 . . . . 0.0 111.529 -177.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -56.5 -41.69 77.11 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 122.736 0.414 . . . . 0.0 110.219 176.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -62.03 -45.93 91.4 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 124.61 1.164 . . . . 0.0 110.27 -177.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.84 -59.8 4.86 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 175.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.543 HG21 HG23 ' A' ' 30' ' ' VAL . 11.5 t -60.96 -26.1 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 CA-C-O 117.93 -1.033 . . . . 0.0 111.236 -176.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.476 HH11 ' HG3' ' A' ' 21' ' ' ARG . 1.7 ttt85 -66.79 -39.47 87.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 119.933 1.242 . . . . 0.0 110.097 175.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -64.92 123.9 20.63 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.0 -29.16 67.04 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.499 1.119 . . . . 0.0 111.111 176.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.17 -10.13 66.53 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 118.135 -1.369 . . . . 0.0 114.177 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.5 t -71.21 135.62 47.62 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 120.292 2.046 . . . . 0.0 108.05 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.01 -25.99 67.97 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.502 175.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.0 t -75.48 123.69 31.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 105.98 -1.859 . . . . 0.0 105.98 175.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.03 -25.12 3.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 C-N-CA 123.125 0.57 . . . . 0.0 110.333 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.1 p-90 -125.33 147.21 49.23 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 119.113 0.869 . . . . 0.0 109.25 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.543 HG23 HG21 ' A' ' 20' ' ' VAL . 5.5 t -139.83 162.96 25.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 128.032 2.533 . . . . 0.0 107.306 178.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 80.7 p -128.33 161.55 29.15 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 175.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -133.6 123.69 25.54 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.5 mmtt -94.37 176.41 6.31 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 176.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -118.93 142.9 47.36 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 175.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -137.1 152.48 50.05 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 175.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 32.86 -98.96 0.01 OUTLIER Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.629 2.061 . . . . 0.0 113.646 176.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.29 39.44 3.25 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.058 1.743 . . . . 0.0 110.467 176.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -142.08 175.69 9.54 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.508 1.123 . . . . 0.0 111.503 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 32.0 mm -107.31 135.52 45.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 104.729 -2.322 . . . . 0.0 104.729 175.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.4 m -129.47 158.05 74.48 Favored Pre-proline 0 N--CA 1.47 0.532 0 CA-C-O 118.741 -0.647 . . . . 0.0 110.472 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.71 165.4 32.84 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 121.962 1.775 . . . . 0.0 110.355 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -134.16 -157.86 8.35 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 125.485 1.517 . . . . 0.0 110.557 176.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.8 mp0 -59.03 158.44 8.57 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 125.212 1.405 . . . . 0.0 109.398 176.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.401 ' HB3' HG22 ' A' ' 30' ' ' VAL . 3.6 pt20 -156.78 155.59 31.84 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.768 1.227 . . . . 0.0 108.107 -176.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.7 -179.15 40.73 Favored Glycine 0 CA--C 1.527 0.782 0 CA-C-O 121.589 0.549 . . . . 0.0 113.156 -175.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.85 -26.24 11.33 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.101 1.36 . . . . 0.0 112.186 177.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -111.77 128.94 56.25 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 -175.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -83.08 -10.61 58.61 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.611 1.964 . . . . 0.0 113.11 -175.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -53.96 -37.98 64.49 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 120.06 1.3 . . . . 0.0 110.572 175.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -69.01 -34.06 74.65 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.413 1.085 . . . . 0.0 111.602 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -58.48 -39.23 79.41 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.559 1.144 . . . . 0.0 109.51 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.9 mm -59.79 -32.55 49.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 123.874 0.87 . . . . 0.0 109.173 -176.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -79.31 -24.05 43.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.034 1.334 . . . . 0.0 112.441 -176.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -80.94 -23.55 38.77 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.634 1.174 . . . . 0.0 112.609 -175.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 79.6 m -79.39 114.47 18.35 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.777 1.231 . . . . 0.0 108.918 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.2 p -130.16 -173.6 3.09 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 122.475 1.131 . . . . 0.0 111.259 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.4 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 9.6 p-10 -40.77 -76.57 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.49 1 C-N-CA 134.673 5.189 . . . . 0.0 117.67 -175.862 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.4 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 17.2 t70 -106.21 -6.46 18.47 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 125.958 1.703 . . . . 0.0 114.077 -175.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.8 m -68.69 131.32 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 O-C-N 120.816 -1.177 . . . . 0.0 110.063 -176.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.6 ptt-85 -103.95 123.51 47.3 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 101.216 -3.624 . . . . 0.0 101.216 175.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.6 tp -141.76 163.21 33.53 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 123.619 0.767 . . . . 0.0 110.01 -175.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -131.48 152.12 50.98 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.509 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -142.32 163.75 32.02 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.315 0.579 . . . . 0.0 111.274 176.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -138.06 123.68 19.75 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 105.3 -2.111 . . . . 0.0 105.3 -176.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.0 t -133.72 138.46 50.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -175.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.1 ttp-105 -80.91 114.9 20.11 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 175.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -131.85 133.33 44.53 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.615 1.166 . . . . 0.0 108.986 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 122.232 1.015 . . . . 0.0 111.034 -176.507 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 69.3 m . . . . . 0 N--CA 1.446 -0.652 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.3 mmtm -64.5 167.73 6.71 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.49 1.138 . . . . 0.0 112.82 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.48 148.12 42.25 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 175.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.6 t -146.51 123.92 11.67 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 104.513 -2.403 . . . . 0.0 104.513 175.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.6 mttt -135.93 176.37 8.75 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -175.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -132.31 127.17 35.03 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.037 -176.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.57 117.76 34.84 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.883 1.673 . . . . 0.0 106.82 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -87.11 113.31 22.75 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 104.3 -2.481 . . . . 0.0 104.3 175.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mt -98.23 146.55 7.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 -176.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.2 m -126.03 123.58 38.76 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 103.317 -2.846 . . . . 0.0 103.317 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 25.6 t-105 -103.28 123.46 46.82 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 175.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.437 HD11 HG21 ' A' ' 97' ' ' THR . 13.3 mm -143.03 101.44 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 105.386 -2.079 . . . . 0.0 105.386 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -60.42 154.63 33.85 Favored Glycine 0 CA--C 1.535 1.303 0 N-CA-C 108.329 -1.909 . . . . 0.0 108.329 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -74.57 -3.35 30.51 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 120.342 -1.681 . . . . 0.0 111.177 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -82.95 -36.01 25.52 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 120.833 -1.167 . . . . 0.0 109.248 -175.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -70.91 123.82 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 104.921 -2.252 . . . . 0.0 104.921 175.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.9 t -78.52 171.74 14.68 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 122.759 1.266 . . . . 0.0 113.547 -174.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -46.84 -35.36 7.76 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 129.12 3.248 . . . . 0.0 113.661 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 tt -62.49 -57.38 11.41 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 119.937 1.869 . . . . 0.0 110.719 176.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -66.1 -37.77 86.59 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 121.774 -0.579 . . . . 0.0 109.885 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -61.41 -33.1 73.13 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.832 -0.542 . . . . 0.0 110.012 175.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.4 -28.63 69.92 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 117.952 -1.023 . . . . 0.0 111.156 176.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -63.06 -55.47 25.2 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 175.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.437 HG21 HD11 ' A' ' 85' ' ' ILE . 13.0 m -50.33 -47.28 55.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.769 0.827 . . . . 0.0 109.764 175.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -59.62 -25.73 61.42 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.026 0.822 . . . . 0.0 114.263 178.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 49.5 m -103.12 -9.41 19.71 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 127.82 2.448 . . . . 0.0 111.155 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -104.52 -23.56 13.12 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 127.118 2.167 . . . . 0.0 112.238 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -48.36 -36.67 14.97 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 119.896 1.226 . . . . 0.0 113.061 176.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.0 t -59.76 -34.2 72.68 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.828 HD11 ' HB ' ' A' ' 6' ' ' THR . 15.4 mt -68.33 -61.66 1.74 Allowed 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 126.616 1.966 . . . . 0.0 109.963 -176.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.2 p -61.84 -30.4 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 117.502 -1.237 . . . . 0.0 108.489 175.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -41.69 99.52 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 120.76 1.618 . . . . 0.0 109.23 175.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -58.91 -25.63 63.58 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.46 1.027 . . . . 0.0 112.806 177.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 29.9 t -86.04 -54.07 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 59.1 t -76.09 21.93 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 C-N-CA 128.753 2.821 . . . . 0.0 112.218 -175.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -48.83 -22.76 0.88 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.862 1.665 . . . . 0.0 115.309 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -107.29 85.21 2.09 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -147.51 175.26 10.98 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.351 1.86 . . . . 0.0 108.524 176.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.14 -60.37 1.62 Allowed 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -175.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.49 173.76 12.01 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.873 1.269 . . . . 0.0 110.325 -178.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -126.59 158.62 35.78 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.452 1.101 . . . . 0.0 111.034 175.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -138.53 155.42 48.41 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 104.949 -2.241 . . . . 0.0 104.949 -175.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 46.8 t -128.53 130.11 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 175.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.5 mp -132.65 153.15 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 126.468 1.907 . . . . 0.0 107.099 -176.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.6 p -149.26 -9.85 0.32 Allowed 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.451 1.901 . . . . 0.0 114.443 -175.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -129.9 154.92 46.83 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.211 1.005 . . . . 0.0 110.756 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.58 HH12 ' CD ' ' A' ' 124' ' ' GLU . 0.0 OUTLIER -69.49 -29.75 67.47 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.587 -176.586 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -76.48 -46.59 26.11 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 121.501 1.955 . . . . 0.0 107.096 174.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -55.34 -23.9 26.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.916 2.087 . . . . 0.0 112.258 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -79.66 -22.87 42.98 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.747 1.619 . . . . 0.0 113.709 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.58 ' CD ' HH12 ' A' ' 120' ' ' ARG . 18.8 mt-10 -69.74 129.04 38.5 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 116.031 1.863 . . . . 0.0 116.031 -175.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.473 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 14.2 mm-40 -53.09 -17.47 1.58 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 125.538 1.535 . . . . 0.0 114.849 175.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.426 ' HA ' ' NZ ' ' A' ' 129' ' ' LYS 0.36 15.3 t70 -65.11 -57.95 7.29 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 117.657 -1.617 . . . . 0.0 112.756 -175.605 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -77.69 -26.3 50.14 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 117.949 -1.5 . . . . 0.0 109.907 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.473 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 51.7 mt -56.53 -40.89 71.07 Favored 'Isoleucine or valine' 0 C--N 1.344 0.345 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.426 ' NZ ' ' HA ' ' A' ' 126' ' ' ASP . 28.1 mtmm -52.85 -52.35 57.58 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 119.905 1.229 . . . . 0.0 111.283 176.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.2 t -73.79 -24.19 59.8 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.622 -178.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -67.63 -49.75 61.42 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 175.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.01 -23.9 62.34 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.29 1.036 . . . . 0.0 111.092 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -67.5 -52.93 33.3 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 174.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -53.73 -48.82 69.27 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.588 1.085 . . . . 0.0 110.103 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.455 0 C-N-CA 124.415 1.086 . . . . 0.0 112.378 -179.391 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.384 0 N-CA-C 105.424 -2.065 . . . . 0.0 105.424 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.708 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.4 m -134.29 165.24 25.58 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.035 1.734 . . . . 0.0 106.412 -175.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -128.03 178.45 6.19 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.115 -0.991 . . . . 0.0 111.006 -175.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.417 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -138.19 151.35 24.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 122.732 0.413 . . . . 0.0 110.095 176.639 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -99.74 77.73 2.08 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 103.076 -2.935 . . . . 0.0 103.076 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -24.13 66.46 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.027 -1.463 . . . . 0.0 110.47 -175.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -66.46 -59.88 3.26 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 120.228 1.377 . . . . 0.0 109.799 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.62 93.15 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.979 0.912 . . . . 0.0 109.853 -178.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.473 ' HB3' HG11 ' A' ' 107' ' ' VAL . 62.5 m -66.78 -36.94 83.58 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.361 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 68.9 ttt-85 -63.7 -35.45 80.61 Favored 'General case' 0 C--N 1.345 0.405 0 CA-C-N 119.11 0.868 . . . . 0.0 109.111 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.47 -50.61 72.49 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.526 0.603 . . . . 0.0 109.965 -175.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.525 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -67.39 -44.88 77.82 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.435 0.294 . . . . 0.0 111.781 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -51.35 -39.3 56.77 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.646 1.178 . . . . 0.0 111.444 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -65.9 -42.41 90.24 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.399 0.68 . . . . 0.0 111.258 -178.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.3 mp -61.95 -54.87 35.77 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 123.428 0.691 . . . . 0.0 109.977 175.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.433 ' CG2' HG23 ' A' ' 30' ' ' VAL . 13.6 t -55.67 -36.18 41.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 122.83 0.452 . . . . 0.0 111.131 178.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -65.69 -38.25 88.74 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.129 176.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -76.2 123.18 25.45 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 120.166 1.348 . . . . 0.0 109.515 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -67.77 -19.53 65.11 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 121.338 -0.851 . . . . 0.0 111.289 175.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.88 -11.23 84.09 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.801 1.191 . . . . 0.0 112.538 176.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.8 t -74.13 143.24 45.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 175.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -72.37 -14.58 61.75 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.475 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.6 t -86.19 136.59 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 126.825 2.05 . . . . 0.0 109.12 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.53 -27.36 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.436 1.094 . . . . 0.0 110.127 175.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -130.91 154.2 48.35 Favored 'General case' 0 C--N 1.343 0.318 0 CA-C-N 119.836 1.198 . . . . 0.0 111.261 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.525 HG21 ' HB1' ' A' ' 16' ' ' ALA . 5.7 t -139.33 160.94 28.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 128.32 2.648 . . . . 0.0 107.542 176.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 45.1 p -122.41 153.7 38.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 175.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -123.29 123.94 41.86 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 175.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -106.46 175.98 5.32 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 105.222 -2.14 . . . . 0.0 105.222 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -115.06 152.41 32.55 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 175.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -147.59 124.2 11.1 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 53.24 -84.51 0.01 OUTLIER Glycine 0 CA--C 1.53 1.02 0 C-N-CA 126.003 1.764 . . . . 0.0 114.857 176.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.8 p -136.07 25.25 3.29 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.988 1.315 . . . . 0.0 112.009 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -145.7 169.81 17.73 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 119.177 0.899 . . . . 0.0 112.229 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.3 mm -96.48 138.38 21.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 104.282 -2.488 . . . . 0.0 104.282 175.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.3 m -130.79 147.89 67.96 Favored Pre-proline 0 CA--C 1.531 0.25 0 C-N-CA 122.822 0.449 . . . . 0.0 110.947 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.73 139.99 34.79 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 121.566 1.511 . . . . 0.0 108.457 175.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -110.67 -147.65 11.31 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 125.506 1.527 . . . . 0.0 109.793 176.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -59.28 160.3 6.72 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 123.763 0.825 . . . . 0.0 111.179 175.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -141.28 166.06 25.82 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 126.137 1.775 . . . . 0.0 108.641 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.27 179.41 41.38 Favored Glycine 0 N--CA 1.452 -0.291 0 O-C-N 121.593 -0.692 . . . . 0.0 113.033 -175.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -124.14 -12.8 7.37 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 125.559 1.544 . . . . 0.0 113.476 -175.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -131.98 144.82 51.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -83.5 -9.04 59.22 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.429 0.691 . . . . 0.0 110.518 -174.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -58.31 -37.02 74.24 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.327 -1.483 . . . . 0.0 110.219 175.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 19.4 m80 -76.04 -29.34 58.03 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.261 1.024 . . . . 0.0 110.549 175.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -60.51 -32.87 71.87 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 121.565 -0.71 . . . . 0.0 111.994 178.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.5 mm -57.6 -35.62 51.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.4 mm-40 -71.87 -23.57 61.53 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.287 1.435 . . . . 0.0 112.345 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -65.03 -34.62 78.87 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 120.842 -1.161 . . . . 0.0 110.688 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.63 112.86 19.21 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 -176.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.3 p -113.82 172.53 6.92 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.753 1.621 . . . . 0.0 112.66 -175.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -46.38 -71.36 0.07 Allowed 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 118.267 2.691 . . . . 0.0 118.267 -174.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -106.58 -31.34 8.54 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -175.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.8 m -70.88 153.3 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.95 0 O-C-N 120.991 -1.068 . . . . 0.0 110.896 -175.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.87 148.16 26.47 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 175.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.3 tp -145.93 162.98 36.55 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.478 1.111 . . . . 0.0 109.495 -175.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -128.16 152.51 47.95 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.429 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.96 143.89 29.78 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 118.34 0.518 . . . . 0.0 112.137 176.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -109.88 123.73 50.1 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 176.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.5 t -133.02 138.99 50.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 122.72 0.408 . . . . 0.0 111.564 -175.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -79.95 120.5 24.24 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 104.187 -2.523 . . . . 0.0 104.187 175.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -135.92 164.2 28.49 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 86.0 m . . . . . 0 N--CA 1.45 -0.451 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 -176.234 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.9 m . . . . . 0 N--CA 1.448 -0.555 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.5 mmpm? -77.23 175.56 9.58 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 119.828 -1.795 . . . . 0.0 110.188 175.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -136.72 161.28 36.37 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.169 0.987 . . . . 0.0 108.712 -175.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.8 t -144.58 123.75 12.92 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 175.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mtpt -132.06 123.39 27.13 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 -175.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -86.06 129.39 34.86 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.088 -175.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -104.04 126.02 50.84 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -94.78 113.31 25.06 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 102.759 -3.052 . . . . 0.0 102.759 175.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.8 mp -95.13 143.53 11.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.2 m -125.42 123.22 38.8 Favored 'General case' 0 N--CA 1.435 -1.203 0 N-CA-C 102.66 -3.089 . . . . 0.0 102.66 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -99.67 124.52 44.98 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 104.039 -2.578 . . . . 0.0 104.039 175.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.538 HD11 HG21 ' A' ' 97' ' ' THR . 5.2 mt -139.2 78.62 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 178.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -42.75 137.53 3.39 Favored Glycine 0 C--N 1.339 0.725 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -176.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -62.19 -4.07 1.58 Allowed 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 118.369 1.085 . . . . 0.0 112.485 -175.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -83.12 -35.98 25.17 Favored 'General case' 0 CA--C 1.521 -0.153 0 O-C-N 120.402 -1.437 . . . . 0.0 109.889 178.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.9 p -78.35 123.73 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 119.889 1.222 . . . . 0.0 109.084 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.3 t -146.05 123.63 11.78 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 175.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 133.26 -151.11 19.99 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 124.254 0.931 . . . . 0.0 111.084 -175.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -50.4 -38.5 43.23 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 126.193 1.797 . . . . 0.0 111.656 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -61.38 -38.11 85.83 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.169 1.35 . . . . 0.0 111.484 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.0 ttm180 -71.47 -37.29 71.34 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.751 1.16 . . . . 0.0 108.322 175.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.48 -31.57 72.77 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 118.788 -0.625 . . . . 0.0 111.849 178.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -59.51 -54.27 48.47 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 119.457 1.026 . . . . 0.0 108.394 176.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.538 HG21 HD11 ' A' ' 85' ' ' ILE . 15.8 m -52.16 -40.97 62.18 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.573 0.624 . . . . 0.0 110.367 175.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -58.77 -25.83 59.45 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-O 119.736 -0.48 . . . . 0.0 113.768 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 50.8 m -115.16 -0.29 13.33 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.568 1.184 . . . . 0.0 111.657 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -103.49 -23.14 13.54 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.71 1.604 . . . . 0.0 108.775 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -53.33 -24.43 11.87 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 120.111 1.323 . . . . 0.0 110.437 174.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -64.09 -41.99 97.09 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.246 -0.909 . . . . 0.0 110.639 176.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.708 HD11 ' HB ' ' A' ' 6' ' ' THR . 12.4 mt -62.82 -62.23 1.87 Allowed 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 125.363 1.465 . . . . 0.0 109.007 -176.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.257 0.9 OUTLIER -57.45 -31.32 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 117.501 -1.237 . . . . 0.0 110.702 176.353 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -60.92 -47.58 85.74 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 121.195 1.816 . . . . 0.0 109.8 175.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -54.37 -24.01 17.88 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.089 0.956 . . . . 0.0 111.539 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.473 HG11 ' HB3' ' A' ' 13' ' ' CYS . 61.5 t -86.15 -65.38 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.653 1.181 . . . . 0.0 108.036 175.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 98.1 t -64.8 25.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.814 1 C-N-CA 131.957 4.103 . . . . 0.0 113.747 -175.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -49.42 -26.6 3.39 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 115.553 1.686 . . . . 0.0 115.553 -175.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -105.49 84.44 2.09 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -138.13 176.52 8.63 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 124.787 1.235 . . . . 0.0 108.293 176.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -104.65 -62.38 1.34 Allowed 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.31 0.644 . . . . 0.0 109.869 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -156.45 175.79 13.55 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 127.554 2.342 . . . . 0.0 106.879 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -117.31 170.58 8.59 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 125.024 1.33 . . . . 0.0 111.077 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -141.67 150.54 42.03 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 105.187 -2.153 . . . . 0.0 105.187 -176.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 65.2 t -124.27 128.7 73.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 175.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.4 mp -129.13 142.15 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 125.562 1.545 . . . . 0.0 107.182 -178.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.6 p -135.13 -3.26 2.48 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 175.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -130.85 149.7 52.36 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.094 1.758 . . . . 0.0 109.652 -175.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 14.0 ttp85 -69.46 -30.64 68.58 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.608 -0.71 . . . . 0.0 111.125 -176.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -73.47 -39.01 65.24 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 120.232 1.378 . . . . 0.0 109.095 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -63.86 -23.7 67.46 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.127 0.971 . . . . 0.0 110.35 175.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -71.93 -22.35 61.48 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.741 -1.224 . . . . 0.0 112.571 176.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -61.28 123.81 18.8 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -176.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.407 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 2.9 mm-40 -56.12 -31.59 63.45 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.232 1.013 . . . . 0.0 113.462 175.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -55.48 -43.28 75.39 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -175.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -94.9 -25.87 16.39 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 119.82 1.191 . . . . 0.0 109.473 176.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.407 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 14.9 mt -51.98 -39.7 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 124.782 1.233 . . . . 0.0 107.995 176.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -51.46 -52.29 47.7 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.764 0.711 . . . . 0.0 110.64 175.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -68.23 -40.62 81.99 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.38 0.536 . . . . 0.0 110.583 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -61.47 -39.21 90.06 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.315 -0.866 . . . . 0.0 111.263 178.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.4 mt -73.08 -40.42 65.03 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.767 1.227 . . . . 0.0 110.314 176.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -56.8 -44.54 82.04 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 175.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.75 -49.23 77.24 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.339 1.055 . . . . 0.0 109.208 175.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -177.959 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.396 0 N-CA-C 104.194 -2.521 . . . . 0.0 104.194 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.71 ' HB ' HD11 ' A' ' 103' ' ' LEU . 10.0 m -134.17 178.47 6.94 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.081 1.352 . . . . 0.0 108.328 -175.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.3 tttp -127.35 175.45 8.18 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.197 -0.94 . . . . 0.0 111.58 -175.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -139.97 148.2 23.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 C-N-CA 125.993 1.717 . . . . 0.0 107.851 175.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -91.57 79.47 5.48 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 103.478 -2.786 . . . . 0.0 103.478 175.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -60.64 -23.47 64.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 116.92 -1.514 . . . . 0.0 113.577 -175.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.33 -56.79 4.31 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.813 1.642 . . . . 0.0 109.309 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.43 89.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 119.727 -0.178 . . . . 0.0 111.473 -175.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 100.0 m -72.08 -33.85 68.22 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.474 -0.766 . . . . 0.0 111.082 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -24.89 66.52 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 117.856 -1.069 . . . . 0.0 110.704 176.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.68 -59.07 5.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 120.387 1.449 . . . . 0.0 110.146 176.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.34 -39.01 91.7 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.651 -0.656 . . . . 0.0 111.216 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -55.92 -47.11 78.08 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 118.438 -0.792 . . . . 0.0 109.532 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -54.67 -47.15 73.96 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 124.971 1.308 . . . . 0.0 110.351 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.3 mp -60.11 -53.97 51.48 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 118.465 0.575 . . . . 0.0 111.088 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 40.4 t -65.02 -24.28 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 O-C-N 121.19 -0.944 . . . . 0.0 111.352 -178.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -51.59 10.48 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 125.321 1.448 . . . . 0.0 110.719 176.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.68 123.71 21.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.693 0.679 . . . . 0.0 112.442 -175.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -67.84 -9.17 42.26 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.874 0.87 . . . . 0.0 113.101 -176.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -91.43 -0.57 72.96 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 119.438 1.017 . . . . 0.0 112.491 176.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.5 t -80.79 145.46 31.45 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 119.055 1.428 . . . . 0.0 111.029 178.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -80.47 -35.84 34.26 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.0 127.81 27.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 C-N-CA 125.669 1.587 . . . . 0.0 108.264 176.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -115.75 -23.87 3.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 125.002 1.321 . . . . 0.0 110.991 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -124.98 143.34 50.94 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.594 1.158 . . . . 0.0 108.836 -177.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.7 t -137.16 165.25 28.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 127.647 2.379 . . . . 0.0 109.44 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 82.8 p -132.9 156.33 47.42 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.725 1.21 . . . . 0.0 108.125 175.274 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -128.43 124.47 36.32 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 176.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -99.88 176.32 5.48 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -115.85 145.1 43.15 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 104.939 -2.245 . . . . 0.0 104.939 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -133.58 123.52 25.26 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.218 -2.512 . . . . 0.0 104.218 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 36.48 -96.96 0.01 OUTLIER Glycine 0 CA--C 1.533 1.167 0 C-N-CA 126.469 1.985 . . . . 0.0 113.22 -175.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 p -120.18 35.34 4.89 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.681 1.592 . . . . 0.0 113.197 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -146.49 168.74 20.45 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.31 1.044 . . . . 0.0 111.239 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.2 mm -100.14 138.49 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 175.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.7 m -134.08 161.43 63.79 Favored Pre-proline 0 N--CA 1.473 0.706 0 C-N-CA 123.587 0.755 . . . . 0.0 111.688 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.96 155.93 66.94 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 121.896 1.73 . . . . 0.0 108.469 175.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.02 -144.98 7.13 Favored Glycine 0 CA--C 1.52 0.388 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 176.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -68.97 159.64 32.37 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 175.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -141.11 161.84 36.91 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 125.552 1.541 . . . . 0.0 107.349 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.49 -178.21 46.93 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-O 122.393 0.996 . . . . 0.0 113.155 176.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.97 -26.43 4.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.002 1.321 . . . . 0.0 110.313 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -94.9 123.26 38.26 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -83.12 -14.27 53.95 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.201 0.6 . . . . 0.0 110.599 -176.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -57.74 -38.06 74.67 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.561 -1.337 . . . . 0.0 110.065 175.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -68.68 -32.31 72.04 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.645 -0.659 . . . . 0.0 111.575 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -57.98 -31.92 67.38 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.479 1.112 . . . . 0.0 111.025 178.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 mm -63.97 -47.65 89.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -67.78 -23.62 65.23 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.897 0.879 . . . . 0.0 112.799 176.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -67.8 -25.86 65.8 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 119.975 1.261 . . . . 0.0 111.644 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 74.3 m -73.79 112.89 10.34 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.384 0.611 . . . . 0.0 109.654 -175.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.37 2.1 p -105.23 167.28 9.83 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 127.298 2.239 . . . . 0.0 111.437 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -54.12 -76.68 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 -174.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -100.76 -28.25 12.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 119.685 1.129 . . . . 0.0 113.574 -174.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.0 m -58.77 137.71 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 O-C-N 121.276 -0.89 . . . . 0.0 109.619 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.11 134.9 47.45 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 105.09 -2.189 . . . . 0.0 105.09 175.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.8 tp -130.19 161.99 29.9 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 124.684 1.194 . . . . 0.0 109.801 -175.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.411 ' CE2' HG11 ' A' ' 104' ' ' VAL . 11.6 m-85 -120.52 140.83 50.88 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -130.44 146.16 51.95 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 124.01 0.924 . . . . 0.0 108.856 176.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -123.74 123.62 40.91 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 103.562 -2.755 . . . . 0.0 103.562 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 t -138.07 146.61 26.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 118.917 0.781 . . . . 0.0 110.414 -175.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 20.2 ttm180 -79.69 123.99 28.16 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -128.82 170.75 12.99 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.917 1.287 . . . . 0.0 109.183 176.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 90.6 m . . . . . 0 N--CA 1.451 -0.391 0 C-N-CA 125.106 1.362 . . . . 0.0 107.864 -176.245 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -71.12 175.91 4.87 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 122.36 1.076 . . . . 0.0 108.937 175.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -132.52 150.21 52.19 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 175.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.1 t -125.12 128.92 49.18 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 103.511 -2.774 . . . . 0.0 103.511 175.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -136.08 123.91 22.6 Favored 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -177.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -91.6 128.11 37.3 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.589 -175.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -103.62 121.57 43.2 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 -176.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.79 113.37 23.39 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 105.048 -2.205 . . . . 0.0 105.048 175.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.0 mp -96.15 138.86 20.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 176.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -122.68 123.29 40.79 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 104.269 -2.493 . . . . 0.0 104.269 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 63.8 t-105 -92.13 123.33 35.4 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 104.224 -2.51 . . . . 0.0 104.224 175.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.463 HD11 HG21 ' A' ' 97' ' ' THR . 6.0 mt -150.16 92.06 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 176.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -57.63 174.97 2.01 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 123.933 0.778 . . . . 0.0 113.183 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -86.51 -9.24 56.59 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.47 -1.018 . . . . 0.0 110.67 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -83.86 -31.74 25.61 Favored 'General case' 0 C--O 1.238 0.475 0 O-C-N 121.022 -1.049 . . . . 0.0 109.142 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -65.7 146.39 13.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 118.73 0.695 . . . . 0.0 110.739 -177.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 39.9 t -74.62 151.78 39.31 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 125.602 1.561 . . . . 0.0 110.812 -177.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.2 -28.87 69.82 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 123.907 0.765 . . . . 0.0 111.469 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.2 tt -62.39 -47.96 81.81 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 118.284 1.042 . . . . 0.0 109.653 176.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -65.46 -46.47 79.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.697 -0.668 . . . . 0.0 109.853 175.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.01 -27.9 61.99 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.45 1.023 . . . . 0.0 111.82 177.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.64 -36.68 85.03 Favored 'General case' 0 C--O 1.234 0.272 0 O-C-N 120.7 -1.25 . . . . 0.0 112.104 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -57.02 -46.42 82.37 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 118.641 -0.695 . . . . 0.0 109.515 176.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.463 HG21 HD11 ' A' ' 85' ' ' ILE . 7.2 m -55.38 -42.46 74.0 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 123.66 0.784 . . . . 0.0 109.781 -177.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -70.66 -26.35 74.21 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 119.195 0.907 . . . . 0.0 113.135 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 86.0 m -86.05 -15.95 39.67 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.768 1.227 . . . . 0.0 111.419 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -103.5 -23.73 13.49 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 127.458 2.303 . . . . 0.0 113.225 -175.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -50.0 -27.91 6.16 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.29 1.405 . . . . 0.0 113.004 176.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.2 t -62.88 -38.64 91.68 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.499 1.045 . . . . 0.0 112.072 176.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.71 HD11 ' HB ' ' A' ' 6' ' ' THR . 12.4 mt -65.17 -61.33 2.2 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 125.419 1.488 . . . . 0.0 109.658 -176.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 104' ' ' VAL 0.257 0.8 OUTLIER -58.63 -28.96 38.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-O 118.117 -0.944 . . . . 0.0 109.262 175.636 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.01 -39.52 94.3 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 120.534 1.515 . . . . 0.0 109.653 175.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -54.52 -32.37 58.01 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 120.19 1.359 . . . . 0.0 112.988 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 52.5 t -86.44 -60.01 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 125.123 1.369 . . . . 0.0 111.022 176.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 3.5 t -74.32 26.62 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 129.193 2.997 . . . . 0.0 113.545 -175.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -53.61 -13.58 0.68 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 120.183 -1.573 . . . . 0.0 114.169 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -94.99 29.43 2.41 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.113 1.324 . . . . 0.0 113.08 175.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.37 174.12 9.32 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 175.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -123.69 -45.62 2.03 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.672 -0.642 . . . . 0.0 110.974 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.72 175.6 8.67 Favored 'General case' 0 C--O 1.235 0.29 1 C-N-CA 131.842 4.057 . . . . 0.0 106.333 175.811 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -132.1 171.4 13.68 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.82 0.848 . . . . 0.0 111.267 -178.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -146.85 149.98 34.35 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 40.3 t -123.62 124.22 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 175.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.7 mt -122.12 146.01 27.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 125.701 1.6 . . . . 0.0 109.521 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 12.8 p -140.08 -8.45 1.18 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.493 1.294 . . . . 0.0 114.493 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -137.41 154.4 49.97 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.743 1.156 . . . . 0.0 109.32 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 29.1 ttp-105 -50.6 -46.53 58.01 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 124.165 0.986 . . . . 0.0 110.733 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -63.45 -38.19 90.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 118.587 0.63 . . . . 0.0 110.295 -176.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -72.62 -23.92 61.0 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.81 1.244 . . . . 0.0 110.491 177.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -79.57 -23.72 42.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.923 1.689 . . . . 0.0 111.527 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -69.77 123.56 21.74 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.099 1.318 . . . . 0.0 110.543 -176.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.1 -13.87 14.03 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.813 1.245 . . . . 0.0 113.717 -178.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -56.09 -65.93 0.52 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.363 1.865 . . . . 0.0 112.802 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -77.34 -25.86 51.49 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 118.263 -1.375 . . . . 0.0 108.815 -175.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 19.5 mt -50.21 -41.17 18.46 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 C-N-CA 125.569 1.548 . . . . 0.0 108.444 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 33.4 mttp -55.95 -56.33 21.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.582 -0.723 . . . . 0.0 111.054 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 43.4 t -67.76 -33.27 74.53 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.613 1.097 . . . . 0.0 110.754 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -60.86 -52.79 63.56 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.583 1.083 . . . . 0.0 109.791 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.8 mt -59.87 -41.05 90.67 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 124.656 1.183 . . . . 0.0 111.125 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -62.55 -52.58 62.87 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 123.645 0.778 . . . . 0.0 110.804 176.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -61.61 -45.84 92.35 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 119.331 0.969 . . . . 0.0 109.182 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.444 0 C-N-CA 124.508 1.123 . . . . 0.0 111.693 175.602 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.216 0 CA-C-O 123.195 1.474 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.654 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.7 m -89.85 162.51 15.44 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 125.522 1.529 . . . . 0.0 107.868 176.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -133.45 -172.01 2.85 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 120.962 -1.086 . . . . 0.0 111.202 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.18 151.78 29.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 125.409 1.484 . . . . 0.0 108.964 175.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -86.7 79.0 9.0 Favored 'General case' 0 N--CA 1.464 0.272 1 N-CA-C 99.399 -4.297 . . . . 0.0 99.399 174.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.9 pttm -54.05 -35.4 61.97 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -74.49 -44.03 53.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 119.372 0.987 . . . . 0.0 109.469 -175.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.67 -45.86 73.99 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 118.13 0.423 . . . . 0.0 111.537 176.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 84.8 m -69.88 -41.6 74.56 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 119.382 -0.342 . . . . 0.0 110.574 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 -64.39 -32.29 73.85 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 116.631 -1.652 . . . . 0.0 109.777 175.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.87 -53.64 52.99 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 120.69 1.586 . . . . 0.0 110.029 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.443 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -56.23 -47.37 78.59 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.976 0.807 . . . . 0.0 110.98 176.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -55.54 -44.04 76.37 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.137 0.426 . . . . 0.0 111.005 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.54 -46.89 88.51 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 125.429 1.492 . . . . 0.0 109.612 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.2 mp -60.72 -46.57 89.88 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.789 0.722 . . . . 0.0 110.163 175.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.75 -39.38 81.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 123.598 0.759 . . . . 0.0 110.301 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -48.55 78.22 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -54.41 135.72 44.91 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 123.024 1.392 . . . . 0.0 113.032 -175.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -86.03 -22.69 27.12 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.679 1.992 . . . . 0.0 110.297 -178.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.35 -8.15 86.69 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.005 0.812 . . . . 0.0 112.947 176.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.7 t -81.21 139.62 35.41 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 118.653 1.226 . . . . 0.0 108.815 176.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -76.8 -35.65 57.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.311 0.644 . . . . 0.0 110.206 175.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.3 t -57.07 133.22 21.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 124.174 0.99 . . . . 0.0 108.935 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.09 -24.41 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 123.217 0.607 . . . . 0.0 109.656 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 49.3 p-90 -130.31 145.99 51.84 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 119.897 1.226 . . . . 0.0 110.366 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.443 HG11 ' HB1' ' A' ' 16' ' ' ALA . 49.9 t -137.28 168.42 21.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 175.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.43 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 76.5 p -132.02 161.01 34.23 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 175.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -135.19 123.9 23.77 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.76 -2.311 . . . . 0.0 104.76 -177.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -99.17 175.85 5.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 106.722 -1.585 . . . . 0.0 106.722 -176.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.448 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 24.0 m-85 -119.85 139.19 52.76 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 177.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -140.21 123.16 16.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 47.23 -98.47 0.01 OUTLIER Glycine 0 CA--C 1.526 0.768 0 C-N-CA 125.043 1.306 . . . . 0.0 113.818 -176.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 p -120.6 25.15 9.93 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.86 2.464 . . . . 0.0 111.745 -175.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -149.34 166.27 29.51 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.448 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 36.4 mm -92.88 133.1 35.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 175.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.7 m -126.7 160.95 55.97 Favored Pre-proline 0 N--CA 1.468 0.457 0 C-N-CA 123.406 0.682 . . . . 0.0 110.741 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.21 167.37 26.99 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 121.463 1.442 . . . . 0.0 109.11 175.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -139.23 -140.58 3.97 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.222 1.392 . . . . 0.0 112.13 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -66.86 156.42 35.73 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 126.749 2.02 . . . . 0.0 110.228 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -149.29 158.27 44.03 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 125.02 1.328 . . . . 0.0 110.14 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -173.39 174.68 46.12 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 123.91 0.767 . . . . 0.0 112.672 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.77 -8.9 7.85 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.72 1.608 . . . . 0.0 112.686 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.22 135.1 55.19 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 104.278 -2.49 . . . . 0.0 104.278 177.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.401 ' CE1' ' CD2' ' A' ' 51' ' ' PHE . 41.0 t80 -86.29 -14.67 43.0 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -175.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -55.28 -44.86 76.07 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.474 1.488 . . . . 0.0 109.532 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -62.68 -22.97 66.88 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.256 1.022 . . . . 0.0 112.028 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.401 ' CD2' ' CE1' ' A' ' 48' ' ' TYR . 0.7 OUTLIER -62.51 -55.54 26.53 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.766 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.02 -33.52 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.138 0.575 . . . . 0.0 109.815 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -62.49 -48.18 80.7 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -74.17 -22.43 59.42 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 -175.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 86.9 m -51.57 119.97 4.69 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 121.481 1.946 . . . . 0.0 110.727 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 p -101.54 164.18 11.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.458 1.503 . . . . 0.0 113.178 -175.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -49.77 -70.58 0.08 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 130.658 3.583 . . . . 0.0 119.251 -174.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -106.53 -36.49 6.75 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 124.845 1.258 . . . . 0.0 114.217 -175.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.6 m -58.39 145.36 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 CA-C-O 122.432 1.111 . . . . 0.0 110.397 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.72 139.64 38.69 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 175.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.4 tp -141.38 160.0 41.05 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -126.55 123.52 37.9 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 105.057 -2.201 . . . . 0.0 105.057 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.43 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -104.45 162.23 13.42 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 175.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -137.25 123.15 20.12 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 102.188 -3.264 . . . . 0.0 102.188 178.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.8 t -129.21 134.52 63.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -175.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 41.2 ttt85 -77.1 113.54 14.94 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 105.115 -2.18 . . . . 0.0 105.115 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -116.64 173.77 6.44 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 126.368 1.867 . . . . 0.0 108.963 -175.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 37.0 m . . . . . 0 C--N 1.327 -0.383 0 O-C-N 121.278 -0.889 . . . . 0.0 109.887 -176.013 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.8 m . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -69.26 167.05 17.14 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -138.44 167.9 20.91 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -177.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.3 t -125.58 158.37 34.8 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 175.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.5 mmmt -144.22 171.78 13.83 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 127.048 2.139 . . . . 0.0 107.475 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -144.53 123.88 13.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.532 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.94 129.24 56.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 126.054 1.742 . . . . 0.0 108.432 -176.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -98.57 113.8 25.99 Favored 'General case' 0 C--O 1.222 -0.342 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 175.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.1 mt -103.63 137.57 31.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 -177.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -116.05 122.89 46.51 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 175.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.0 t-105 -97.04 123.29 40.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 103.833 -2.654 . . . . 0.0 103.833 175.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.1 mt -145.56 98.12 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 176.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -59.94 162.86 16.18 Favored Glycine 0 CA--C 1.53 0.992 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -76.08 -6.41 51.0 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 121.07 -1.253 . . . . 0.0 110.998 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -83.2 -35.98 25.03 Favored 'General case' 0 C--N 1.341 0.231 0 O-C-N 121.423 -0.798 . . . . 0.0 109.589 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.7 p -71.56 127.62 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 176.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 48.3 t -63.32 153.44 34.94 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 124.28 1.032 . . . . 0.0 110.805 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -51.28 -29.94 23.71 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 125.678 1.608 . . . . 0.0 113.054 176.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.95 -51.66 69.11 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.355 1.078 . . . . 0.0 110.232 176.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -70.28 -31.49 68.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 118.51 -0.757 . . . . 0.0 110.036 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -63.41 -28.84 70.25 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.757 1.162 . . . . 0.0 109.273 175.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.89 -24.13 61.91 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.569 1.148 . . . . 0.0 111.958 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.36 -35.4 69.9 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 118.787 0.721 . . . . 0.0 110.481 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.7 m -54.8 -33.35 61.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.345 1.058 . . . . 0.0 110.146 175.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.33 -14.27 61.67 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 125.547 1.546 . . . . 0.0 114.481 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 30.0 m -123.18 -3.87 8.48 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.462 1.631 . . . . 0.0 109.894 175.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -103.79 -37.97 7.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 123.919 0.888 . . . . 0.0 112.684 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.5 mtmp? -57.18 -36.9 71.37 Favored 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 120.257 1.39 . . . . 0.0 111.376 -176.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -56.87 -34.06 67.46 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 120.255 1.388 . . . . 0.0 112.046 177.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.654 HD11 ' HB ' ' A' ' 6' ' ' THR . 39.9 mt -66.21 -65.17 0.71 Allowed 'General case' 0 CA--C 1.508 -0.653 0 C-N-CA 125.887 1.675 . . . . 0.0 109.137 -176.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.1 p -57.73 -32.96 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-O 117.846 -1.073 . . . . 0.0 108.519 175.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -67.48 -24.31 65.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 121.144 1.793 . . . . 0.0 111.32 178.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.68 -27.22 66.66 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.92 1.236 . . . . 0.0 110.302 175.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 89.4 t -85.73 -56.68 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 175.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.1 t -70.09 17.35 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 130.17 3.388 . . . . 0.0 112.278 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -57.49 -26.71 61.7 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 119.406 -2.059 . . . . 0.0 111.027 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -94.9 72.35 3.48 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 125.247 1.419 . . . . 0.0 107.521 176.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -143.79 176.21 9.42 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.521 0.728 . . . . 0.0 110.209 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.68 -66.15 0.94 Allowed 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.772 0.829 . . . . 0.0 111.549 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -155.49 176.27 12.81 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.376 2.27 . . . . 0.0 111.778 -175.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -122.95 163.86 19.59 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.975 0.91 . . . . 0.0 111.212 175.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -138.67 147.75 43.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 -175.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.5 t -118.27 123.32 71.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 3.0 mt -132.44 143.27 40.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -176.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 7.7 p -143.24 -0.59 1.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.566 1.146 . . . . 0.0 112.679 -176.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -139.24 157.03 46.63 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.053 1.741 . . . . 0.0 108.846 -175.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -73.54 -41.67 62.68 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.823 -176.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -62.55 -34.37 76.81 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 120.136 1.335 . . . . 0.0 109.429 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -65.48 -23.3 66.87 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.785 1.634 . . . . 0.0 110.768 175.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -86.44 -23.53 26.0 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.657 1.183 . . . . 0.0 113.888 -176.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -57.15 123.84 16.67 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.711 1.204 . . . . 0.0 110.753 -176.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.97 -23.82 66.63 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.529 ' HA ' ' CE ' ' A' ' 129' ' ' LYS 0.356 10.5 t70 -57.69 -52.16 66.59 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 121.454 1.934 . . . . 0.0 113.526 -175.437 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -74.35 -23.15 58.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 116.821 -1.952 . . . . 0.0 109.019 -177.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 56.6 mt -55.78 -41.8 67.43 Favored 'Isoleucine or valine' 0 C--N 1.347 0.473 0 CA-C-N 119.283 0.947 . . . . 0.0 108.519 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.529 ' CE ' ' HA ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -54.73 -51.23 66.29 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 119.91 1.232 . . . . 0.0 111.434 175.588 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.9 t -71.25 -31.39 67.48 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.058 -175.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 36.1 tp10 -63.93 -46.51 84.46 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.612 1.165 . . . . 0.0 108.798 175.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 91.2 mt -66.18 -31.01 71.59 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.555 -0.716 . . . . 0.0 110.412 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? -65.98 -49.13 68.92 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.488 1.04 . . . . 0.0 108.317 175.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 39.9 mtmt -56.46 -45.06 81.04 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.824 0.738 . . . . 0.0 110.117 176.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 125.358 1.463 . . . . 0.0 114.029 176.607 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.16 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.503 ' HB ' HD11 ' A' ' 103' ' ' LEU . 3.2 m -143.05 166.44 24.63 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.065 1.746 . . . . 0.0 106.805 -175.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.5 tttm -130.14 -178.66 4.83 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 124.137 0.975 . . . . 0.0 109.799 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.407 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -135.56 147.81 28.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 176.254 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -89.91 73.06 7.47 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 175.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -31.6 69.84 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-O 118.108 -0.949 . . . . 0.0 109.649 -176.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -63.74 -56.85 12.48 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.26 0.936 . . . . 0.0 109.394 -177.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.18 -43.27 82.6 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 122.27 -0.268 . . . . 0.0 110.846 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 79.9 m -68.91 -28.14 66.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.436 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -61.5 -38.86 88.86 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.527 176.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.44 -56.3 23.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 119.358 0.981 . . . . 0.0 109.771 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.412 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -61.06 -42.93 99.42 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.862 -0.524 . . . . 0.0 111.268 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -53.34 -48.48 68.45 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 175.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -61.56 -47.01 87.45 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 124.93 1.292 . . . . 0.0 110.348 -176.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -63.74 -27.39 69.17 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.422 ' CG2' HG23 ' A' ' 30' ' ' VAL . 6.6 t -83.53 -33.27 9.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 118.889 0.768 . . . . 0.0 109.948 175.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -70.56 -44.69 66.89 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.493 1.917 . . . . 0.0 111.743 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -70.83 123.49 22.1 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.646 1.578 . . . . 0.0 113.162 -175.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -72.21 -11.83 60.9 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.705 0.802 . . . . 0.0 110.217 175.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.74 -26.6 62.47 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 125.514 1.531 . . . . 0.0 111.705 175.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.2 t -85.92 150.24 24.64 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.915 1.686 . . . . 0.0 108.709 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.93 -14.58 44.3 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.215 0.606 . . . . 0.0 111.723 175.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.6 t -70.53 133.54 31.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -176.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.31 -24.06 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 118.456 -0.783 . . . . 0.0 111.44 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 55.0 p-90 -131.61 153.15 50.22 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 120.014 1.279 . . . . 0.0 110.83 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.422 HG23 ' CG2' ' A' ' 20' ' ' VAL . 4.7 t -140.86 164.37 21.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 129.663 3.185 . . . . 0.0 109.122 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 39.2 p -128.82 158.56 38.36 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.366 1.466 . . . . 0.0 107.883 175.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -133.56 123.69 25.58 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.5 mtpt -99.63 176.9 5.32 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 175.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -117.53 144.13 45.39 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 175.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -142.83 156.47 44.95 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 175.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 35.92 -104.7 0.03 OUTLIER Glycine 0 CA--C 1.53 0.992 0 C-N-CA 125.742 1.639 . . . . 0.0 112.065 -175.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.6 p -129.89 41.96 3.35 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 127.443 2.297 . . . . 0.0 109.456 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.9 t -149.55 172.73 14.54 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.113 0.965 . . . . 0.0 112.349 -175.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.5 mm -99.62 140.03 19.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 175.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.7 m -129.85 156.57 78.76 Favored Pre-proline 0 N--CA 1.469 0.514 0 C-N-CA 123.436 0.694 . . . . 0.0 110.551 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -71.46 154.35 60.57 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.812 1.674 . . . . 0.0 109.98 175.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -126.28 -158.21 9.82 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 125.738 1.637 . . . . 0.0 109.703 176.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -53.17 157.55 1.83 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 126.607 1.963 . . . . 0.0 111.468 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.2 pm0 -144.57 169.86 17.17 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.269 1.428 . . . . 0.0 109.885 177.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -172.61 166.47 39.16 Favored Glycine 0 CA--C 1.522 0.48 0 CA-C-O 122.222 0.901 . . . . 0.0 112.76 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -99.23 -18.51 17.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.239 1.416 . . . . 0.0 110.548 175.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 49' ' ' GLN . 4.9 tp10 -129.2 139.02 52.03 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 176.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.419 ' CE1' ' CD2' ' A' ' 51' ' ' PHE . 53.8 t80 -83.82 -5.18 59.15 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.633 1.973 . . . . 0.0 113.077 -175.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.42 ' H ' ' HG3' ' A' ' 47' ' ' GLU . 18.2 tt0 -57.72 -36.85 72.58 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 120.62 -1.3 . . . . 0.0 110.958 176.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -65.77 -39.9 91.49 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.943 0.897 . . . . 0.0 110.504 176.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.419 ' CD2' ' CE1' ' A' ' 48' ' ' TYR . 33.2 t80 -56.97 -34.94 68.57 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 125.223 1.409 . . . . 0.0 112.029 -176.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 mm -60.03 -35.75 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 24.8 mm100 -85.86 -24.15 26.81 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.429 1.492 . . . . 0.0 112.457 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -67.48 -24.66 65.62 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 118.942 0.792 . . . . 0.0 111.467 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 78.0 m -75.21 113.42 12.54 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.311 2.1 p -92.89 171.23 9.1 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.595 1.558 . . . . 0.0 112.667 -175.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -47.21 -74.65 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 118.118 2.636 . . . . 0.0 118.118 -174.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -107.51 -35.62 6.7 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 127.323 2.249 . . . . 0.0 115.965 -174.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.4 m -54.93 155.53 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 N-CA-C 114.714 1.376 . . . . 0.0 114.714 -175.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 26.7 ptt-85 -103.99 135.32 45.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.6 tp -142.74 165.71 26.64 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 125.989 1.716 . . . . 0.0 107.249 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -131.41 154.55 48.53 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.488 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -136.45 151.97 50.07 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 123.581 0.752 . . . . 0.0 111.222 176.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -123.46 123.57 40.95 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 104.191 -2.522 . . . . 0.0 104.191 175.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.9 t -130.36 139.27 51.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 122.866 0.467 . . . . 0.0 109.879 -175.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -86.8 126.61 34.73 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 106.179 -1.785 . . . . 0.0 106.179 175.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -136.11 168.36 19.52 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -175.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.327 -0.398 0 O-C-N 120.717 -1.239 . . . . 0.0 108.066 175.779 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.445 -0.68 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -67.13 165.45 15.92 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -133.31 153.96 51.12 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 105.667 -1.975 . . . . 0.0 105.667 175.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 t -129.59 123.93 32.53 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 176.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 49.5 mttt -132.49 145.54 51.25 Favored 'General case' 0 CA--C 1.503 -0.864 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -114.65 144.68 43.04 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.439 -0.8 . . . . 0.0 108.981 -175.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -116.24 121.22 41.4 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 -178.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -91.02 113.36 25.6 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 102.251 -3.24 . . . . 0.0 102.251 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -103.05 143.93 14.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -122.43 123.53 41.53 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 104.737 -2.32 . . . . 0.0 104.737 175.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.8 t-105 -100.78 124.03 45.83 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 104.033 -2.58 . . . . 0.0 104.033 175.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.2 mm -127.12 98.62 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 175.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -44.22 126.85 6.38 Favored Glycine 0 C--N 1.342 0.867 0 N-CA-C 107.008 -2.437 . . . . 0.0 107.008 176.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -54.5 -7.64 0.17 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 -175.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -83.56 -35.87 24.41 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.755 1.622 . . . . 0.0 112.454 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.4 p -75.07 135.75 26.58 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 CA-C-N 121.029 1.74 . . . . 0.0 111.62 -175.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.0 t -146.4 176.7 9.59 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.821 1.248 . . . . 0.0 108.909 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 81.05 -142.58 23.37 Favored Glycine 0 CA--C 1.521 0.443 0 O-C-N 121.654 -0.654 . . . . 0.0 113.062 175.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 9.2 tt -53.18 -44.66 68.09 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 124.791 1.237 . . . . 0.0 110.578 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -60.83 -35.55 76.82 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.115 0.566 . . . . 0.0 110.953 -177.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.8 ttt-85 -70.7 -44.56 66.7 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.209 -0.932 . . . . 0.0 108.542 175.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.69 68.87 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.184 0.594 . . . . 0.0 112.444 177.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -58.62 -54.71 44.0 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 175.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.0 m -51.7 -45.67 63.59 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 119.513 1.051 . . . . 0.0 109.974 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -60.4 -25.88 63.43 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-O 119.91 -0.383 . . . . 0.0 113.729 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.8 m -101.4 -9.83 20.77 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.058 1.743 . . . . 0.0 111.232 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -103.84 -23.81 13.36 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 126.134 1.773 . . . . 0.0 112.462 -175.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 42.1 mtpt -54.25 -31.84 54.53 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.466 1.484 . . . . 0.0 112.035 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 5.4 t -66.84 -29.4 69.31 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.288 0.949 . . . . 0.0 112.226 175.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.503 HD11 ' HB ' ' A' ' 6' ' ' THR . 10.7 mt -68.21 -63.55 1.04 Allowed 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 125.169 1.388 . . . . 0.0 108.758 -176.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.36 -29.02 41.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 118.04 -0.981 . . . . 0.0 108.741 175.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.6 tttp -65.82 -27.34 68.18 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 120.87 1.668 . . . . 0.0 110.72 175.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -65.02 -27.51 68.86 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 121.224 1.829 . . . . 0.0 111.107 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 72.8 t -85.71 -48.87 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 175.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 65.6 t -84.46 26.07 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 128.796 2.838 . . . . 0.0 111.15 -175.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -56.93 -26.32 59.23 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 121.246 1.839 . . . . 0.0 110.942 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -90.08 80.66 6.3 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.954 1.702 . . . . 0.0 106.867 175.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -148.6 176.31 10.44 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 175.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.42 -64.69 1.26 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.899 0.88 . . . . 0.0 111.789 -175.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -132.03 172.32 12.51 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.353 1.461 . . . . 0.0 110.366 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -125.89 164.54 20.52 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.757 1.223 . . . . 0.0 108.234 175.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -150.96 146.07 26.01 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 103.831 -2.655 . . . . 0.0 103.831 -175.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.7 t -122.98 123.82 68.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 3.3 mt -129.41 150.82 34.99 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 125.459 1.504 . . . . 0.0 108.76 -175.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.0 p -151.27 0.34 0.38 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.34 1.056 . . . . 0.0 113.804 177.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.455 ' OD1' ' HE2' ' A' ' 121' ' ' LYS . 5.0 t70 -126.03 145.87 50.13 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.15 1.38 . . . . 0.0 108.906 -175.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 45.4 ttt85 -65.46 -33.93 77.08 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.455 ' HE2' ' OD1' ' A' ' 119' ' ' ASP . 7.4 mtmm -68.78 -45.64 70.8 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 120.125 1.33 . . . . 0.0 108.169 175.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.02 -23.77 62.25 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.466 1.907 . . . . 0.0 111.596 -179.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -78.16 -22.85 48.09 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.571 1.948 . . . . 0.0 113.782 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -69.99 129.84 40.57 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.562 1.528 . . . . 0.0 113.592 -176.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -57.92 -25.79 61.35 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.082 1.353 . . . . 0.0 113.715 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -53.61 -55.04 29.24 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 123.869 0.868 . . . . 0.0 112.495 -176.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -86.37 -23.86 26.02 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 118.517 -1.273 . . . . 0.0 109.029 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 64.4 mt -55.06 -40.13 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 175.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -52.14 -54.27 32.66 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.977 0.808 . . . . 0.0 110.012 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.4 ' HA ' ' HE3' ' A' ' 133' ' ' LYS . 4.2 t -69.0 -36.03 77.36 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.957 -0.544 . . . . 0.0 111.27 -177.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -64.3 -39.46 93.97 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.991 1.269 . . . . 0.0 110.054 176.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 67.5 mt -69.78 -30.52 68.1 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 120.94 -1.1 . . . . 0.0 110.1 175.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 130' ' ' SER . 8.0 mtmp? -67.25 -45.94 75.22 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 175.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -57.21 -55.78 30.27 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 124.407 1.083 . . . . 0.0 111.811 179.305 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.452 0 CA-C-O 122.023 0.916 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.603 ' HB ' HD11 ' A' ' 103' ' ' LEU . 5.0 m -121.99 176.1 5.97 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.215 1.806 . . . . 0.0 106.575 178.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -137.86 -179.22 5.64 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.733 -1.23 . . . . 0.0 113.584 -175.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.23 148.6 32.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 C-N-CA 124.522 1.129 . . . . 0.0 108.891 175.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -94.43 76.73 3.88 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 102.455 -3.165 . . . . 0.0 102.455 175.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.6 ttpt -60.26 -27.22 67.06 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 118.047 -0.978 . . . . 0.0 112.812 -175.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -69.35 -57.96 4.62 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 119.588 1.085 . . . . 0.0 109.927 176.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.96 -40.58 83.18 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.758 0.708 . . . . 0.0 110.982 -178.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.6 m -67.68 -29.84 69.21 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 121.369 -0.832 . . . . 0.0 111.4 -178.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.7 ttt85 -60.65 -33.18 72.43 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-O 117.418 -1.277 . . . . 0.0 109.508 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.63 -51.48 69.23 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 120.126 1.33 . . . . 0.0 110.118 -179.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.515 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -60.49 -49.71 76.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 121.913 -0.492 . . . . 0.0 110.835 178.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -56.27 -38.92 71.82 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.051 0.54 . . . . 0.0 111.196 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -62.93 -55.88 22.04 Favored 'General case' 0 CA--C 1.522 -0.126 0 C-N-CA 124.854 1.262 . . . . 0.0 110.046 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mp -59.84 -32.17 70.43 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 81.6 t -75.62 -34.55 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-N 118.487 0.585 . . . . 0.0 109.528 176.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -72.33 -42.72 65.07 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 119.271 0.942 . . . . 0.0 111.239 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.64 136.64 57.19 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 126.408 1.883 . . . . 0.0 114.022 -175.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.412 ' CG ' HH22 ' A' ' 66' ' ' ARG . 0.8 OUTLIER -86.27 -21.91 27.1 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.539 1.536 . . . . 0.0 113.049 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.24 -33.07 36.86 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 108.789 -1.725 . . . . 0.0 108.789 175.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 t -66.4 123.72 20.77 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 175.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -78.04 -6.76 55.58 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.144 0.578 . . . . 0.0 111.442 175.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.6 t -70.17 127.42 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 175.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.04 -23.82 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 CA-C-O 118.376 -0.821 . . . . 0.0 109.716 175.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 38.6 p-90 -130.71 140.46 50.35 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.737 1.153 . . . . 0.0 110.701 178.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.515 HG11 ' HB1' ' A' ' 16' ' ' ALA . 35.0 t -139.59 152.3 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 175.244 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 37.2 p -103.56 158.8 16.11 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -127.91 123.97 36.24 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -110.63 176.33 5.08 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -176.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -119.54 140.66 50.17 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 177.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -141.01 136.02 31.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 55.59 -96.35 0.04 OUTLIER Glycine 0 CA--C 1.531 1.045 0 CA-C-N 119.001 0.819 . . . . 0.0 111.654 -178.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.2 p -136.26 28.74 3.08 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.31 1.844 . . . . 0.0 111.333 175.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.8 t -143.92 163.66 32.81 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 -175.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.2 mm -83.67 138.94 18.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.0 m -134.26 159.43 72.33 Favored Pre-proline 0 C--N 1.329 -0.309 0 C-N-CA 124.765 1.226 . . . . 0.0 109.534 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.42 162.08 36.57 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 CA-C-N 120.801 1.322 . . . . 0.0 108.887 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -127.61 -165.0 11.78 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 126.263 1.887 . . . . 0.0 109.832 175.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -56.06 159.27 3.43 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.723 1.209 . . . . 0.0 110.914 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -145.2 168.21 20.94 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.184 1.394 . . . . 0.0 111.843 -175.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.1 -174.62 43.69 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 122.23 0.906 . . . . 0.0 112.328 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.41 -21.06 7.61 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.998 1.719 . . . . 0.0 110.992 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -106.24 117.36 33.83 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.571 1.148 . . . . 0.0 108.695 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -82.79 -16.09 49.17 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.24 0.616 . . . . 0.0 110.151 -177.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -62.57 -27.28 69.07 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 119.545 -1.972 . . . . 0.0 109.964 175.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -76.07 -31.4 58.75 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.74 1.216 . . . . 0.0 111.05 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -57.51 -35.97 70.94 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 125.009 1.323 . . . . 0.0 110.383 178.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.7 mm -58.58 -33.68 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 -176.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -77.78 -24.02 49.0 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.485 1.114 . . . . 0.0 112.213 177.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -72.3 -24.09 61.27 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 119.804 1.184 . . . . 0.0 112.091 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.5 m -65.97 132.97 49.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.772 0.715 . . . . 0.0 109.763 -177.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.256 2.1 p -112.95 163.5 14.59 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.696 1.998 . . . . 0.0 110.622 -176.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -50.05 -76.38 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 130.224 3.41 . . . . 0.0 117.314 -175.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -102.67 -36.09 8.45 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 123.669 0.788 . . . . 0.0 112.667 -175.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.4 m -56.73 147.98 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 CA-C-O 122.264 1.03 . . . . 0.0 112.078 -175.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.443 ' NE ' ' H ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -103.58 136.42 43.34 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.454 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 41.4 tp -138.19 167.81 21.05 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.918 1.287 . . . . 0.0 108.088 -176.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -132.39 146.97 52.35 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -144.45 124.49 13.59 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 118.39 0.541 . . . . 0.0 109.87 175.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.427 ' CE1' HG13 ' A' ' 108' ' ' VAL . 26.6 t80 -90.31 123.67 34.27 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 175.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.3 t -133.96 140.86 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 121.397 0.617 . . . . 0.0 109.764 -175.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.412 HH22 ' CG ' ' A' ' 23' ' ' ASP . 48.7 ttt180 -84.73 139.0 32.3 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.37 1.468 . . . . 0.0 108.667 175.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -136.2 150.24 48.91 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.159 1.384 . . . . 0.0 108.508 -176.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 99.3 m . . . . . 0 C--N 1.33 -0.268 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.324 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.3 m . . . . . 0 CA--C 1.536 0.417 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -63.3 163.59 10.28 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.852 0.834 . . . . 0.0 109.662 175.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.4 mmt85 -128.29 167.72 16.52 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 126.25 1.82 . . . . 0.0 108.096 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.3 t -133.24 142.48 48.56 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.0 mmtp -141.5 172.15 13.08 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 125.939 1.696 . . . . 0.0 108.002 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -145.55 130.03 17.85 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -177.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.83 119.02 33.61 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.69 113.24 21.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 103.295 -2.854 . . . . 0.0 103.295 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -85.28 132.89 30.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 176.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -116.46 123.28 47.11 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 101.873 -3.38 . . . . 0.0 101.873 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.1 t-105 -102.29 126.87 49.41 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 106.325 -1.732 . . . . 0.0 106.325 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.4 HG21 ' HG3' ' A' ' 94' ' ' ARG . 8.5 mt -138.48 102.0 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 N-CA-C 104.471 -2.418 . . . . 0.0 104.471 175.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.91 125.13 37.87 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 105.992 -2.843 . . . . 0.0 105.992 175.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -55.68 -3.88 0.09 Allowed 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 119.95 1.875 . . . . 0.0 115.003 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 -82.97 -31.35 27.64 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 120.596 -1.315 . . . . 0.0 109.723 177.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.9 p -69.58 136.66 25.75 Favored 'Isoleucine or valine' 0 C--N 1.343 0.31 0 CA-C-N 120.306 1.412 . . . . 0.0 109.588 176.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.3 t -144.04 177.01 8.87 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.306 1.442 . . . . 0.0 108.702 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.02 -145.3 49.63 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 176.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.68 -42.32 78.84 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 124.557 1.143 . . . . 0.0 110.901 -176.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -59.83 -43.42 94.57 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 119.215 0.916 . . . . 0.0 110.06 -176.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.4 ' HG3' HG21 ' A' ' 85' ' ' ILE . 12.5 ttp180 -69.64 -44.21 71.07 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.425 -0.797 . . . . 0.0 109.069 175.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.58 -23.47 50.95 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.144 0.978 . . . . 0.0 112.548 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -51.24 -53.82 31.68 Favored 'General case' 0 CA--C 1.504 -0.808 0 CA-C-N 119.772 1.169 . . . . 0.0 108.356 175.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.3 m -57.05 -41.04 77.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.737 0.699 . . . . 0.0 111.558 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.78 -18.78 64.51 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-N 118.161 0.437 . . . . 0.0 112.843 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.6 m -103.41 -17.74 15.12 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.416 1.086 . . . . 0.0 111.677 176.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -103.05 -23.99 13.65 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 117.755 2.502 . . . . 0.0 117.755 -174.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.2 mtmt -50.12 -28.01 6.61 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 122.212 2.278 . . . . 0.0 114.089 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.5 t -62.92 -35.5 80.3 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.119 1.327 . . . . 0.0 111.657 176.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.603 HD11 ' HB ' ' A' ' 6' ' ' THR . 22.6 mt -61.73 -64.54 0.91 Allowed 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 126.554 1.942 . . . . 0.0 109.054 -176.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.409 HG12 ' H ' ' A' ' 104' ' ' VAL . 0.9 OUTLIER -56.92 -32.73 40.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.343 175.87 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -26.34 64.89 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 120.748 1.613 . . . . 0.0 111.793 175.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -64.38 -28.19 69.53 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 120.719 -1.238 . . . . 0.0 110.165 175.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 95.5 t -86.6 -65.59 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 125.338 1.455 . . . . 0.0 108.294 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.427 HG13 ' CE1' ' A' ' 64' ' ' PHE . 19.9 t -67.58 27.4 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.882 1 C-N-CA 132.97 4.508 . . . . 0.0 113.464 -175.687 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -52.63 -26.15 12.81 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.184 -1.573 . . . . 0.0 114.309 -175.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -104.83 95.22 5.73 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -150.66 163.33 38.78 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.298 1.039 . . . . 0.0 108.95 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.81 -66.69 0.58 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.83 163.46 5.01 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 131.493 3.917 . . . . 0.0 105.836 175.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -85.6 173.16 10.36 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 122.521 0.328 . . . . 0.0 111.018 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -129.59 157.45 42.05 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.5 t -116.95 123.81 72.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 175.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mt -132.06 126.71 56.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . 0.382 2.8 p -126.6 1.22 6.85 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 115.848 1.796 . . . . 0.0 115.848 175.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -146.17 158.03 43.86 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.802 0.841 . . . . 0.0 110.358 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -55.49 -42.25 74.14 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.836 175.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.42 -27.56 67.58 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 120.561 1.528 . . . . 0.0 112.612 178.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -83.37 -23.97 32.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.518 1.127 . . . . 0.0 110.751 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -75.56 -23.79 56.59 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.014 2.126 . . . . 0.0 113.091 -178.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -68.8 123.18 20.24 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -175.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.417 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 4.0 mm-40 -50.69 -32.12 18.41 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 115.973 1.842 . . . . 0.0 115.973 175.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -56.3 -32.31 64.48 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -108.03 -21.54 12.77 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.45 1.023 . . . . 0.0 108.589 175.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.417 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 46.8 mt -56.15 -36.97 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 175.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -58.73 -53.67 55.71 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.771 -0.581 . . . . 0.0 110.345 176.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 9.1 t -64.65 -31.79 73.17 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.135 0.879 . . . . 0.0 111.89 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -65.29 -52.89 51.19 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 124.997 1.319 . . . . 0.0 109.146 176.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 47.3 mt -60.88 -34.72 75.05 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.499 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -62.13 -52.98 61.67 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.194 0.906 . . . . 0.0 108.846 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 26.5 mmtt -54.28 -52.58 60.99 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.413 0.685 . . . . 0.0 110.928 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.278 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -175.979 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.34 0 CA-C-O 121.561 0.696 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.573 ' HB ' HD11 ' A' ' 103' ' ' LEU . 3.4 m -110.38 170.74 7.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.335 1.854 . . . . 0.0 106.07 175.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -125.09 172.71 9.25 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.778 -1.201 . . . . 0.0 110.819 -176.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.419 ' HA ' ' H ' ' A' ' 39' ' ' ILE . 0.1 OUTLIER -142.68 153.4 17.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 C-N-CA 124.582 1.153 . . . . 0.0 109.29 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -94.6 73.37 3.71 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 102.69 -3.078 . . . . 0.0 102.69 175.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 31.4 pttt -58.88 -27.84 65.57 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 117.454 -1.26 . . . . 0.0 111.448 -175.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.2 -56.39 5.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.191 0.997 . . . . 0.0 110.068 -175.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.78 -35.45 77.07 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 121.2 -0.2 . . . . 0.0 110.684 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.0 m -69.46 -34.21 74.05 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 118.534 -0.746 . . . . 0.0 110.363 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 76.0 ttt-85 -60.09 -39.63 86.82 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.846 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.62 -59.0 5.31 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 123.878 0.737 . . . . 0.0 109.489 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.41 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -64.14 -36.7 84.89 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.873 -0.517 . . . . 0.0 112.121 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.417 ' CE1' ' HA ' ' A' ' 108' ' ' VAL . 17.7 t80 -62.2 -28.77 69.91 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.181 0.992 . . . . 0.0 111.207 175.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -74.89 -46.37 36.49 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 124.264 1.025 . . . . 0.0 109.376 175.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.5 mp -57.13 -56.39 22.35 Favored 'General case' 0 C--O 1.221 -0.396 0 O-C-N 121.586 -0.696 . . . . 0.0 110.627 175.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.9 t -59.45 -29.08 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 118.494 0.588 . . . . 0.0 111.13 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -69.94 -45.43 67.49 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 119.992 1.269 . . . . 0.0 111.224 175.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -63.36 123.65 19.25 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.994 1.718 . . . . 0.0 111.311 -175.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -64.81 -27.85 69.16 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.975 1.31 . . . . 0.0 111.992 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.15 -11.31 76.27 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 124.4 1.0 . . . . 0.0 112.669 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -62.08 128.75 37.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 119.046 1.423 . . . . 0.0 108.461 176.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.26 -35.78 82.1 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.8 t -72.5 126.26 32.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 125.42 1.488 . . . . 0.0 108.23 175.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.3 pp -113.72 -23.68 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 124.967 1.307 . . . . 0.0 111.062 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -128.08 145.63 50.94 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.784 0.72 . . . . 0.0 109.975 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.41 HG21 ' HB1' ' A' ' 16' ' ' ALA . 9.5 t -135.83 161.82 37.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 126.482 1.913 . . . . 0.0 107.636 176.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.447 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 14.2 p -119.54 159.26 24.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.377 1.071 . . . . 0.0 108.939 175.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -137.09 127.8 27.11 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.378 1.471 . . . . 0.0 107.254 -177.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -113.74 176.75 4.9 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 127.074 2.15 . . . . 0.0 107.805 -178.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -118.91 138.22 52.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 175.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -137.48 132.43 33.3 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 59.12 -107.43 1.2 Allowed Glycine 0 CA--C 1.529 0.945 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -175.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.1 p -130.09 29.84 4.87 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.899 1.279 . . . . 0.0 111.704 175.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -130.37 169.1 15.91 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.635 0.652 . . . . 0.0 110.215 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.419 ' H ' ' HA ' ' A' ' 8' ' ' ILE . 38.5 mm -94.98 138.33 21.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 104.21 -2.515 . . . . 0.0 104.21 175.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.3 m -130.81 154.32 81.86 Favored Pre-proline 0 C--N 1.329 -0.309 0 C-N-CA 124.067 0.947 . . . . 0.0 110.326 176.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -75.81 159.66 38.21 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 C-N-CA 121.986 1.791 . . . . 0.0 109.386 175.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -130.62 -162.77 10.8 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 127.201 2.334 . . . . 0.0 108.965 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -58.93 166.92 1.78 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 126.2 1.8 . . . . 0.0 111.723 -176.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.74 171.31 16.44 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 124.749 1.219 . . . . 0.0 111.127 -175.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -171.97 -178.06 41.98 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 123.763 0.697 . . . . 0.0 111.891 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.3 -26.69 7.08 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.871 1.268 . . . . 0.0 111.378 176.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -105.81 130.26 53.82 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 105.672 -1.973 . . . . 0.0 105.672 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.419 ' CE2' ' CD2' ' A' ' 51' ' ' PHE . 21.6 t80 -82.84 -9.47 59.31 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.511 0.724 . . . . 0.0 110.413 -175.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -54.22 -33.73 59.0 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.329 -1.482 . . . . 0.0 110.607 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.4 m80 -68.27 -25.04 64.97 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.305 1.442 . . . . 0.0 112.772 176.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.419 ' CD2' ' CE2' ' A' ' 48' ' ' TYR . 0.6 OUTLIER -62.84 -52.41 63.24 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.158 -0.964 . . . . 0.0 108.842 178.393 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.41 -40.31 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -178.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -61.23 -32.81 72.59 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.172 0.989 . . . . 0.0 112.362 175.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -81.27 -23.59 37.86 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 117.857 -1.068 . . . . 0.0 113.563 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 92.4 m -53.62 114.35 1.5 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 120.183 1.356 . . . . 0.0 111.756 -175.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.25 2.0 p -83.91 164.8 19.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.91 2.084 . . . . 0.0 112.153 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -55.34 -77.12 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 131.153 3.781 . . . . 0.0 120.645 -175.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -106.56 -20.79 13.26 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 127.042 2.137 . . . . 0.0 114.673 -174.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.0 m -68.11 168.67 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-O 122.484 1.135 . . . . 0.0 113.388 -175.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.75 123.37 42.51 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 103.109 -2.923 . . . . 0.0 103.109 175.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 42.7 tp -130.65 168.12 17.66 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.864 2.066 . . . . 0.0 109.072 -175.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -132.5 155.45 48.55 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 123.547 0.739 . . . . 0.0 109.679 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -146.23 137.25 24.41 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.272 0.629 . . . . 0.0 110.86 176.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -104.91 123.83 48.42 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 105.864 -1.902 . . . . 0.0 105.864 175.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.7 t -133.11 136.52 55.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 -175.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.3 ttp-105 -80.83 134.44 35.78 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -136.1 159.75 40.75 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.835 0.854 . . . . 0.0 108.97 -175.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.7 m . . . . . 0 N--CA 1.454 -0.258 0 O-C-N 120.612 -1.305 . . . . 0.0 109.137 -177.25 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.0 m . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -62.99 157.47 21.81 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -122.15 162.66 20.9 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 -176.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.2 t -138.87 142.13 38.6 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 106.255 -1.757 . . . . 0.0 106.255 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -143.8 173.97 11.22 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 127.271 2.228 . . . . 0.0 106.525 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -146.35 139.04 25.37 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.83 121.39 43.85 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 175.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.96 113.35 25.59 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 101.52 -3.511 . . . . 0.0 101.52 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mp -94.31 144.37 9.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 -178.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -124.05 123.45 40.38 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 103.186 -2.894 . . . . 0.0 103.186 175.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -100.11 128.63 46.16 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 105.129 -2.174 . . . . 0.0 105.129 175.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.0 mt -131.84 103.64 7.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 102.723 -3.065 . . . . 0.0 102.723 175.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -55.42 122.84 28.03 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 106.8 -2.52 . . . . 0.0 106.8 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -55.0 -3.61 0.05 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.561 1.544 . . . . 0.0 114.154 -175.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -83.53 -23.84 31.89 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.692 1.597 . . . . 0.0 110.343 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.9 p -85.87 144.98 8.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-N 120.714 1.597 . . . . 0.0 108.884 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.6 t -146.3 176.56 9.67 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 126.21 1.804 . . . . 0.0 107.41 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 61.04 -146.9 47.55 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 123.312 0.482 . . . . 0.0 113.54 176.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.3 tt -47.11 -51.39 18.0 Favored 'General case' 0 C--N 1.335 -0.029 0 C-N-CA 126.079 1.752 . . . . 0.0 113.504 -175.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.45 -38.36 86.91 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 120.277 1.399 . . . . 0.0 111.174 -178.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.2 ttt180 -65.78 -47.65 74.46 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 175.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.83 -27.02 66.27 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.613 1.165 . . . . 0.0 112.991 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -50.82 -42.53 58.4 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 120.34 1.427 . . . . 0.0 110.281 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.7 m -54.62 -35.6 63.59 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 124.783 1.233 . . . . 0.0 110.256 -177.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.93 -26.33 74.48 Favored Glycine 0 CA--C 1.526 0.77 0 O-C-N 121.499 -0.75 . . . . 0.0 112.817 179.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.8 m -95.39 -8.69 34.9 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.545 1.538 . . . . 0.0 111.016 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -104.22 -29.66 10.68 Favored 'General case' 0 CA--C 1.514 -0.417 0 O-C-N 121.044 -1.035 . . . . 0.0 111.771 -175.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.1 mtpt -52.82 -35.24 56.79 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 118.932 0.787 . . . . 0.0 110.686 176.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.8 t -62.91 -37.64 87.77 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.73 0.695 . . . . 0.0 111.947 176.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.573 HD11 ' HB ' ' A' ' 6' ' ' THR . 7.0 mt -63.43 -60.02 3.92 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 124.388 1.075 . . . . 0.0 109.665 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.85 -30.96 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 117.726 -1.131 . . . . 0.0 109.886 176.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.66 -46.47 88.93 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 120.337 1.426 . . . . 0.0 109.887 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -56.32 -25.07 47.59 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 77.8 t -85.29 -62.51 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.417 ' HA ' ' CE1' ' A' ' 17' ' ' TYR . 21.2 t -68.77 27.25 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.887 1 C-N-CA 131.864 4.065 . . . . 0.0 113.706 -175.454 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -54.12 -26.55 28.03 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 119.789 -1.819 . . . . 0.0 115.098 -175.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -94.87 81.38 3.76 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 175.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -142.04 170.79 15.05 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 125.406 1.482 . . . . 0.0 108.752 176.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -87.55 -66.58 0.9 Allowed 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.71 176.24 12.62 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 128.856 2.863 . . . . 0.0 106.26 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.46 169.39 9.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.827 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -141.04 149.57 41.85 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 103.927 -2.62 . . . . 0.0 103.927 -175.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 48.4 t -121.94 128.67 75.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.7 mt -133.38 148.78 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 125.632 1.573 . . . . 0.0 107.976 -176.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 79.4 p -145.19 1.69 0.97 Allowed 'General case' 0 C--O 1.235 0.29 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -127.2 136.45 52.05 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 125.612 1.565 . . . . 0.0 107.387 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.43 -50.49 40.51 Favored 'General case' 0 CA--C 1.517 -0.302 0 C-N-CA 123.945 0.898 . . . . 0.0 110.683 177.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -33.92 76.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 118.01 0.368 . . . . 0.0 110.504 -175.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -67.51 -23.32 65.45 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.937 1.295 . . . . 0.0 110.781 175.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -85.1 -23.91 28.28 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 125.315 1.446 . . . . 0.0 112.728 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -58.45 123.81 17.46 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.21 0.914 . . . . 0.0 109.671 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.552 ' HB3' ' HE3' ' A' ' 129' ' ' LYS . 27.5 mt-10 -65.35 -19.54 66.0 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 121.35 -0.844 . . . . 0.0 113.274 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -51.98 -51.43 57.31 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.139 0.881 . . . . 0.0 112.779 -175.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -85.62 -24.31 27.18 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.045 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 41.9 mt -56.92 -38.59 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 119.783 1.174 . . . . 0.0 108.376 175.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.552 ' HE3' ' HB3' ' A' ' 125' ' ' GLU . 41.4 mttt -52.94 -50.64 63.63 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.196 0.598 . . . . 0.0 109.783 176.179 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.5 t -66.0 -35.31 80.21 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.184 1.394 . . . . 0.0 112.064 176.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -63.7 -47.88 79.37 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.285 0.948 . . . . 0.0 109.201 176.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.77 -34.34 77.03 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.976 0.91 . . . . 0.0 109.88 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -65.57 -42.89 91.28 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.103 0.865 . . . . 0.0 109.274 175.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? -61.72 -52.83 62.64 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.641 0.776 . . . . 0.0 109.756 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.691 0 C-N-CA 124.202 1.001 . . . . 0.0 112.499 176.045 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.556 0 CA-C-O 121.467 0.651 . . . . 0.0 111.406 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.2 m -134.72 168.78 18.39 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 127.239 2.215 . . . . 0.0 105.797 176.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 45.4 tttm -138.51 172.54 12.73 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 120.642 -1.286 . . . . 0.0 108.836 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.431 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -122.84 149.52 26.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.004 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -83.23 85.03 7.28 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 103.432 -2.803 . . . . 0.0 103.432 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -62.54 -23.72 67.13 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.484 -1.246 . . . . 0.0 113.119 -175.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -79.13 -57.5 3.7 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 119.874 1.215 . . . . 0.0 108.112 179.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.17 -35.61 81.36 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.714 -176.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 82.9 m -80.04 -32.77 39.47 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 119.054 0.843 . . . . 0.0 111.037 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.7 ttt-85 -66.78 -26.86 67.17 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 117.328 -1.32 . . . . 0.0 109.713 175.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.89 -62.46 1.65 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 120.44 1.473 . . . . 0.0 109.441 176.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.428 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -54.79 -47.59 73.8 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.289 0.636 . . . . 0.0 111.431 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -52.15 -46.92 65.61 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 122.44 0.296 . . . . 0.0 110.965 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -64.41 -40.74 96.36 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.1 -0.953 . . . . 0.0 111.35 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.7 mp -60.4 -61.38 2.64 Favored 'General case' 0 C--O 1.221 -0.419 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 175.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.1 t -58.15 -32.96 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 122.806 0.442 . . . . 0.0 111.914 -175.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.85 -26.35 63.23 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 119.234 0.925 . . . . 0.0 110.9 176.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -76.02 127.41 32.9 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 118.986 0.812 . . . . 0.0 110.201 -177.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -61.37 -28.18 69.05 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.808 -0.557 . . . . 0.0 111.113 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.78 1.37 78.82 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.578 1.085 . . . . 0.0 113.627 178.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.8 t -85.98 124.9 32.95 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 120.627 2.213 . . . . 0.0 107.856 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.4 -33.12 71.01 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.9 t -64.73 131.01 30.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 C-N-CA 125.067 1.347 . . . . 0.0 107.389 175.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.3 pp -114.19 -23.62 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.448 1.499 . . . . 0.0 111.037 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.1 p-90 -131.74 146.89 52.41 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 118.814 0.733 . . . . 0.0 111.201 178.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.428 HG11 ' HB1' ' A' ' 16' ' ' ALA . 39.9 t -141.46 150.25 19.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 175.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.415 HG22 ' HB2' ' A' ' 63' ' ' ALA . 38.8 p -103.62 161.74 13.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -130.79 137.96 49.69 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 105.886 -1.894 . . . . 0.0 105.886 175.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -125.61 177.04 6.46 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 126.664 1.985 . . . . 0.0 107.396 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -118.52 137.28 53.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -133.96 123.83 25.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 175.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 58.3 -80.81 0.01 OUTLIER Glycine 0 CA--C 1.529 0.925 0 C-N-CA 126.005 1.764 . . . . 0.0 113.896 176.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.53 10.03 3.71 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.747 2.419 . . . . 0.0 113.664 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -149.82 173.24 13.97 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 120.266 1.394 . . . . 0.0 113.047 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 18.6 mm -84.28 140.03 16.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 175.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.4 m -131.17 160.52 66.63 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 125.482 1.513 . . . . 0.0 110.781 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.55 156.53 36.21 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.497 2.131 . . . . 0.0 109.94 175.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -126.46 -166.83 12.3 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 126.141 1.829 . . . . 0.0 109.532 175.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -54.05 161.67 1.18 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 117.948 0.874 . . . . 0.0 112.891 175.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.8 pm0 -141.79 164.71 29.46 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 127.582 2.353 . . . . 0.0 110.653 -175.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -167.03 172.73 42.2 Favored Glycine 0 CA--C 1.525 0.675 0 CA-C-O 121.837 0.687 . . . . 0.0 111.652 176.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -111.93 -2.7 15.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.647 1.179 . . . . 0.0 112.663 -176.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -139.47 150.41 45.14 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -83.6 -9.85 58.64 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.755 0.707 . . . . 0.0 111.875 -175.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -58.49 -39.57 80.38 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 120.597 -1.314 . . . . 0.0 110.252 175.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -76.21 -14.41 60.15 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.986 1.315 . . . . 0.0 112.781 176.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -72.84 -36.8 67.54 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 123.552 0.741 . . . . 0.0 110.147 175.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.7 mm -55.76 -44.97 79.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.31 0.644 . . . . 0.0 109.841 -175.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -61.72 -23.56 66.22 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.358 1.063 . . . . 0.0 113.495 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -70.99 -30.92 67.31 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.628 1.104 . . . . 0.0 112.1 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 56.7 m -72.25 113.58 9.44 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 105.513 -2.032 . . . . 0.0 105.513 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.265 2.5 p -115.31 166.82 11.44 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.646 1.178 . . . . 0.0 113.273 -175.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -40.47 -69.45 0.13 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 131.008 3.723 . . . . 0.0 119.286 -174.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -106.05 -36.21 7.01 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.535 1.934 . . . . 0.0 115.974 -174.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 33.7 m -69.06 167.44 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-O 123.244 1.497 . . . . 0.0 114.615 -175.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.66 145.37 38.07 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 103.206 -2.887 . . . . 0.0 103.206 174.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.2 tp -144.33 165.05 29.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 119.869 1.213 . . . . 0.0 107.751 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.456 ' CZ ' HG23 ' A' ' 97' ' ' THR . 5.3 m-85 -130.89 152.58 50.07 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 176.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HB2' HG22 ' A' ' 31' ' ' THR . . . -152.97 135.51 15.18 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 119.037 0.835 . . . . 0.0 112.412 175.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -95.83 123.18 39.3 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 104.906 -2.257 . . . . 0.0 104.906 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 50.3 t -133.87 137.94 51.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -176.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -78.13 138.62 38.81 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -135.99 161.63 35.12 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.842 1.657 . . . . 0.0 107.489 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.3 m . . . . . 0 N--CA 1.452 -0.344 0 O-C-N 120.755 -1.216 . . . . 0.0 108.473 -177.887 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.5 m . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.69 154.09 30.46 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.983 0.897 . . . . 0.0 108.984 -178.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -127.73 163.33 24.55 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.519 1.528 . . . . 0.0 108.297 -178.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.6 t -146.35 142.64 28.44 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -138.71 170.2 16.43 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.919 1.688 . . . . 0.0 106.966 176.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -146.38 129.77 16.77 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.8 133.93 49.74 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -99.88 113.21 25.6 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 102.296 -3.224 . . . . 0.0 102.296 175.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.2 mp -91.4 141.31 14.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -123.59 123.21 40.08 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 101.762 -3.422 . . . . 0.0 101.762 175.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.7 t-105 -95.44 123.41 38.96 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 103.84 -2.652 . . . . 0.0 103.84 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.677 HD11 HG21 ' A' ' 97' ' ' THR . 19.8 mt -142.41 85.7 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 102.384 -3.191 . . . . 0.0 102.384 175.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.69 144.48 7.19 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 176.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.9 tm-20 -57.28 -18.56 17.11 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -83.85 -36.23 23.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 124.778 1.231 . . . . 0.0 112.426 -177.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -73.87 123.32 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 107.216 -1.401 . . . . 0.0 107.216 175.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 5.1 t -146.22 176.38 9.79 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.717 1.207 . . . . 0.0 108.942 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 84.47 -148.7 24.13 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.743 -0.598 . . . . 0.0 111.719 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -54.75 -29.9 55.05 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.46 1.104 . . . . 0.0 109.309 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -57.64 -43.57 84.98 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.058 -1.026 . . . . 0.0 110.82 175.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -43.54 74.8 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 175.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.05 -31.07 64.8 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.237 0.615 . . . . 0.0 112.115 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -59.4 -61.42 2.64 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 175.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.677 HG21 HD11 ' A' ' 85' ' ' ILE . 96.4 m -53.75 -40.01 65.8 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 122.656 0.383 . . . . 0.0 110.676 178.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.68 -22.25 61.62 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 123.592 0.615 . . . . 0.0 114.296 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 63.7 m -108.49 -8.1 15.62 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.104 1.361 . . . . 0.0 111.902 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -103.27 -24.74 13.51 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.767 1.227 . . . . 0.0 112.189 -175.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -55.62 -33.27 63.84 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 120.294 1.406 . . . . 0.0 111.383 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.2 t -59.36 -36.84 76.48 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.95 0.795 . . . . 0.0 112.075 175.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.431 ' HB3' HG22 ' A' ' 8' ' ' ILE . 12.7 mt -63.19 -63.84 1.08 Allowed 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 125.14 1.376 . . . . 0.0 109.319 -175.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -32.88 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-O 117.73 -1.128 . . . . 0.0 109.793 175.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.81 -37.41 86.62 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.75 1.614 . . . . 0.0 110.418 176.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.33 -24.77 65.3 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.308 0.958 . . . . 0.0 111.374 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 58.9 t -84.98 -54.02 9.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 175.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 72.1 t -71.85 14.01 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 130.269 3.428 . . . . 0.0 113.35 -175.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -50.25 -26.55 4.84 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 119.759 -1.838 . . . . 0.0 115.119 -175.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -92.32 52.08 1.88 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.241 1.017 . . . . 0.0 109.646 175.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.08 176.46 5.12 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.72 2.008 . . . . 0.0 110.705 177.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.8 -67.07 0.86 Allowed 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -165.09 176.17 8.76 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 128.495 2.718 . . . . 0.0 108.734 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -113.61 173.61 6.33 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 124.663 1.185 . . . . 0.0 111.685 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -147.54 155.99 42.4 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 105.156 -2.164 . . . . 0.0 105.156 -175.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 14.3 t -129.08 124.9 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 175.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mt -125.19 141.29 45.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 125.804 1.641 . . . . 0.0 107.867 -175.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 10.2 p -131.07 -9.81 3.81 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -175.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -145.97 160.64 41.57 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 118.447 0.567 . . . . 0.0 110.771 -175.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -53.38 -42.86 67.35 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.254 1.421 . . . . 0.0 111.204 176.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -67.47 -37.15 82.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.636 0.653 . . . . 0.0 111.989 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -71.77 -23.66 61.63 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.896 0.879 . . . . 0.0 110.545 177.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -80.77 -24.56 38.55 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.095 -1.003 . . . . 0.0 113.38 -176.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -61.5 123.61 18.34 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.904 0.774 . . . . 0.0 111.492 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -54.66 -23.61 18.1 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -56.42 -49.99 72.95 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 -175.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -88.94 -25.65 21.96 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.873 177.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 34.5 mt -52.7 -43.41 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -55.0 -50.48 68.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 119.083 -0.484 . . . . 0.0 111.048 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.5 t -64.08 -43.32 95.77 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-O 118.803 -0.618 . . . . 0.0 110.604 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -53.65 -52.81 58.75 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.543 1.137 . . . . 0.0 109.372 177.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.12 -29.29 70.13 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.008 0.923 . . . . 0.0 112.159 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -72.29 -44.27 63.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.393 1.077 . . . . 0.0 110.018 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 45.8 mmtt -60.53 -53.53 56.46 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 176.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.361 0 C-N-CA 125.186 1.394 . . . . 0.0 113.103 178.5 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.3 m -64.05 157.33 25.54 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.51 2.324 . . . . 0.0 108.409 176.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -131.74 175.44 9.19 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.266 1.026 . . . . 0.0 110.119 -176.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.647 HG22 HG12 ' A' ' 39' ' ' ILE . 0.1 OUTLIER -121.42 151.98 24.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 O-C-N 121.541 -0.725 . . . . 0.0 110.247 176.017 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -87.19 65.71 8.95 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 104.87 -2.271 . . . . 0.0 104.87 175.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.93 -39.93 63.22 Favored 'General case' 0 CA--C 1.512 -0.482 0 C-N-CA 124.395 1.078 . . . . 0.0 111.931 -175.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -67.84 -35.23 78.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 118.753 0.706 . . . . 0.0 111.771 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.29 -50.26 16.64 Favored 'General case' 0 CA--C 1.523 -0.084 0 CA-C-N 119.727 1.149 . . . . 0.0 109.882 175.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.0 m -62.36 -27.79 69.31 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.906 -0.496 . . . . 0.0 110.996 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -58.52 -41.61 85.84 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 117.72 -1.133 . . . . 0.0 109.518 175.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.54 -54.32 38.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 123.779 0.674 . . . . 0.0 110.116 -175.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.08 75.15 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -52.94 -40.66 63.82 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 119.015 -0.517 . . . . 0.0 109.618 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -58.43 -48.77 79.62 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 123.448 0.699 . . . . 0.0 111.013 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mp -54.33 -56.36 19.25 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 124.029 0.932 . . . . 0.0 110.856 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.0 -30.08 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 122.146 -0.346 . . . . 0.0 111.089 -176.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.0 ttp85 -76.89 -25.05 52.59 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.382 1.073 . . . . 0.0 112.273 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -83.67 124.35 30.75 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 126.185 1.794 . . . . 0.0 112.313 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -64.83 -22.27 66.95 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 123.924 0.89 . . . . 0.0 112.869 175.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.76 -14.35 75.77 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-N 119.169 0.895 . . . . 0.0 112.854 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.5 t -70.13 146.03 51.13 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.898 1.349 . . . . 0.0 111.942 -175.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.03 -29.58 23.34 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 175.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.8 t -74.86 129.95 36.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 176.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.87 -24.02 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 O-C-N 124.296 0.997 . . . . 0.0 110.235 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -125.45 144.65 50.43 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 124.349 1.06 . . . . 0.0 109.275 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.9 t -137.53 162.78 32.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 C-N-CA 128.501 2.72 . . . . 0.0 107.631 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 51.0 p -132.06 162.22 31.31 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.601 1.161 . . . . 0.0 108.174 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -133.92 143.82 48.46 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -120.64 176.67 5.4 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.405 ' CE2' HD12 ' A' ' 39' ' ' ILE . 23.9 m-85 -120.33 141.01 50.42 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.479 0.712 . . . . 0.0 109.118 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -151.09 123.83 8.56 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.066 0.946 . . . . 0.0 109.285 175.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 54.19 -125.9 34.91 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.1 p -98.34 30.05 3.34 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 124.516 1.127 . . . . 0.0 111.945 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.6 t -151.84 165.4 34.62 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 175.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.647 HG12 HG22 ' A' ' 8' ' ' ILE . 12.2 mm -89.41 135.03 27.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 103.743 -2.688 . . . . 0.0 103.743 175.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.437 ' HB ' ' HD2' ' A' ' 41' ' ' PRO . 6.0 m -122.34 167.19 14.66 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 124.687 1.195 . . . . 0.0 109.297 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.437 ' HD2' ' HB ' ' A' ' 40' ' ' VAL . 57.0 Cg_endo -66.06 170.08 12.4 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 CA-C-N 120.506 1.216 . . . . 0.0 111.302 176.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -135.41 -168.11 11.5 Favored Glycine 0 CA--C 1.523 0.559 0 C-N-CA 125.614 1.578 . . . . 0.0 109.85 176.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -74.69 170.46 15.78 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 124.566 1.146 . . . . 0.0 109.731 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -146.46 168.47 21.12 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 124.949 1.3 . . . . 0.0 110.206 -176.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.33 -178.03 46.67 Favored Glycine 0 CA--C 1.521 0.41 0 CA-C-O 121.968 0.76 . . . . 0.0 112.772 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.76 -24.11 7.31 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.552 1.541 . . . . 0.0 110.776 176.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -109.12 123.21 48.83 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.4 ' CD1' ' HG3' ' A' ' 125' ' ' GLU . 33.3 t80 -83.1 -15.88 49.08 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.368 -175.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -54.11 -34.54 60.52 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 121.468 1.94 . . . . 0.0 111.666 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -66.16 -32.98 74.75 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 123.429 0.692 . . . . 0.0 112.123 175.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.95 -45.59 67.79 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.292 1.437 . . . . 0.0 109.622 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 mp -63.46 -33.12 59.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.507 -0.745 . . . . 0.0 110.958 -178.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -80.21 -26.45 39.15 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.961 1.304 . . . . 0.0 110.269 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -71.98 -39.02 69.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.451 1.5 . . . . 0.0 110.278 176.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 67.4 m -50.49 114.36 1.11 Allowed 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.953 1.301 . . . . 0.0 111.246 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.619 ' OG1' HG22 ' A' ' 59' ' ' VAL . 2.7 p -84.26 143.24 29.69 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 127.995 2.518 . . . . 0.0 110.635 -176.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -50.54 -59.74 3.72 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 126.172 1.789 . . . . 0.0 112.94 -177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -106.67 -33.79 7.51 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 125.496 1.518 . . . . 0.0 113.927 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.619 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -72.31 155.11 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 C-N-CA 118.086 -1.446 . . . . 0.0 109.429 -175.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.7 151.44 22.99 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -178.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.3 tp -147.48 157.35 43.53 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 124.424 1.09 . . . . 0.0 108.478 -175.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -128.84 142.77 50.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -137.46 124.08 21.01 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 123.838 0.855 . . . . 0.0 112.001 -176.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -95.85 123.57 39.49 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 105.27 -2.122 . . . . 0.0 105.27 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.9 t -136.53 143.57 35.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 123.365 0.666 . . . . 0.0 109.395 -175.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.52 136.2 33.21 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -136.27 170.76 15.51 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.755 2.022 . . . . 0.0 107.81 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--O 1.235 0.298 0 C-N-CA 125.639 1.576 . . . . 0.0 110.116 176.349 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.5 m . . . . . 0 N--CA 1.442 -0.861 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -67.79 154.57 41.23 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 87.9 mtt-85 -111.8 165.68 11.85 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.7 t -133.51 135.99 44.78 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.7 mtpp -139.87 123.97 17.75 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 125.933 1.693 . . . . 0.0 107.791 -175.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.57 134.76 33.62 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 176.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -108.01 127.9 54.18 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.542 1.537 . . . . 0.0 107.169 176.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -103.99 113.27 26.69 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 175.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.8 mp -93.74 135.46 28.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 -177.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -117.38 123.47 46.52 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 106.071 -1.825 . . . . 0.0 106.071 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 52.1 t-105 -100.96 123.41 45.11 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 105.745 -1.946 . . . . 0.0 105.745 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.7 mm -141.56 89.84 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 101.001 -3.703 . . . . 0.0 101.001 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.48 145.0 8.25 Favored Glycine 0 C--N 1.339 0.726 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.44 -5.44 7.72 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.103 0.951 . . . . 0.0 113.134 -175.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -83.3 -35.5 25.2 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 124.799 1.24 . . . . 0.0 111.771 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.2 p -82.71 132.78 30.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 120.074 1.307 . . . . 0.0 109.656 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.5 t -146.22 176.56 9.66 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 126.674 1.99 . . . . 0.0 108.589 -175.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 81.29 -155.48 36.2 Favored Glycine 0 CA--C 1.519 0.311 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.49 -29.56 59.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 122.963 0.505 . . . . 0.0 110.959 -177.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 -57.22 -39.41 75.42 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.872 1.669 . . . . 0.0 111.334 176.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -71.45 -53.05 15.28 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 175.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.65 -23.39 6.49 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 117.225 -1.369 . . . . 0.0 113.527 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -48.82 -44.11 38.98 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 120.678 1.581 . . . . 0.0 109.184 175.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.2 m -56.29 -27.78 56.57 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.983 1.713 . . . . 0.0 111.918 178.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -75.95 -25.92 65.75 Favored Glycine 0 CA--C 1.529 0.943 0 O-C-N 120.809 -1.182 . . . . 0.0 112.449 175.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 54.6 m -93.32 -20.18 20.64 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.806 1.242 . . . . 0.0 110.136 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -104.14 -23.97 13.22 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -174.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -58.14 -33.04 68.75 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 122.353 2.342 . . . . 0.0 111.225 177.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.9 t -68.53 -27.49 66.15 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.663 1.12 . . . . 0.0 112.25 175.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.42 ' O ' HG21 ' A' ' 8' ' ' ILE . 15.5 mt -67.85 -62.16 1.54 Allowed 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.301 0.8 OUTLIER -57.87 -24.69 23.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.313 175.471 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -63.79 -33.19 75.11 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.814 1.643 . . . . 0.0 109.57 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -62.34 -24.26 67.23 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 120.665 1.575 . . . . 0.0 111.816 175.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 92.2 t -86.01 -63.4 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 41.5 t -73.13 26.16 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 131.64 3.976 . . . . 0.0 112.71 -175.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -54.25 -26.0 26.41 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 119.751 -1.843 . . . . 0.0 111.643 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -97.37 88.84 4.52 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 175.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -153.08 176.44 11.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.436 0.636 . . . . 0.0 111.003 176.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -108.61 -66.03 1.08 Allowed 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.432 1.093 . . . . 0.0 109.982 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.98 174.88 11.11 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 119.044 0.838 . . . . 0.0 109.464 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . 0.254 0.0 OUTLIER -118.84 169.62 9.7 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.625 1.17 . . . . 0.0 109.599 175.495 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.415 ' CD1' HD11 ' A' ' 117' ' ' ILE . 0.5 OUTLIER -144.15 149.15 36.02 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 104.205 -2.517 . . . . 0.0 104.205 -175.662 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.31 123.47 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.415 HD11 ' CD1' ' A' ' 115' ' ' PHE . 2.8 mp -130.87 145.22 35.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 125.286 1.434 . . . . 0.0 107.889 -176.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 p -136.65 -9.46 1.88 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.741 1.216 . . . . 0.0 113.76 -176.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -115.42 124.46 51.22 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 176.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 17.8 ttp-105 -59.49 -36.68 76.52 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.92 0.888 . . . . 0.0 111.721 -177.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -35.96 77.05 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 120.254 1.388 . . . . 0.0 111.422 177.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.88 -41.52 91.48 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 123.744 0.653 . . . . 0.0 110.324 -175.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -43.61 -23.11 0.06 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 131.456 3.903 . . . . 0.0 115.425 -176.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -43.93 141.41 1.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.014 1.726 . . . . 0.0 111.222 175.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.4 ' HG3' ' CD1' ' A' ' 48' ' ' TYR . 7.2 mt-10 -61.42 -21.84 64.46 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -175.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.485 ' HA ' ' HE3' ' A' ' 129' ' ' LYS 0.276 7.9 t70 -65.81 -43.57 88.27 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 121.541 1.973 . . . . 0.0 113.448 -175.168 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.16 -26.39 60.28 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 113.84 -3.144 . . . . 0.0 106.44 -176.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 58.5 mt -60.64 -49.54 84.04 Favored 'Isoleucine or valine' 0 C--N 1.345 0.39 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 175.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.485 ' HE3' ' HA ' ' A' ' 126' ' ' ASP . 15.4 mtmt -56.26 -45.91 79.88 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.554 -0.716 . . . . 0.0 111.327 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -73.53 -38.17 65.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 119.403 1.002 . . . . 0.0 110.904 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -66.52 -43.73 84.42 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.51 1.524 . . . . 0.0 109.879 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.06 -36.69 82.39 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -67.2 -41.4 85.88 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 124.551 1.14 . . . . 0.0 111.429 175.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -62.02 -41.35 97.99 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 120.832 1.651 . . . . 0.0 109.135 175.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.661 0 C-N-CA 123.667 0.787 . . . . 0.0 112.212 175.742 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 61.2 m -116.23 161.14 19.42 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 103.766 -2.679 . . . . 0.0 103.766 175.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.536 ' HG2' ' H ' ' A' ' 8' ' ' ILE . 38.6 tttt -132.26 -174.01 3.32 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 121.144 -0.973 . . . . 0.0 110.555 -175.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.536 ' H ' ' HG2' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -132.39 151.68 35.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 125.825 1.65 . . . . 0.0 108.298 175.647 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -103.2 86.32 2.66 Favored 'General case' 0 C--O 1.236 0.352 1 N-CA-C 98.488 -4.634 . . . . 0.0 98.488 174.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -55.13 -29.37 57.57 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 116.899 -1.524 . . . . 0.0 113.757 -175.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -74.33 -50.43 18.78 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 120.878 1.672 . . . . 0.0 110.222 -176.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.14 90.0 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.63 ' HB3' HG11 ' A' ' 107' ' ' VAL . 17.1 m -68.88 -41.95 77.63 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.526 -0.734 . . . . 0.0 112.117 175.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -57.06 -37.62 72.09 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 117.85 -1.071 . . . . 0.0 109.855 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.27 -35.6 69.96 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 119.005 0.82 . . . . 0.0 111.984 -176.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.59 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -78.43 -50.17 12.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 119.185 0.902 . . . . 0.0 111.274 175.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -49.47 -43.76 45.39 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.757 1.223 . . . . 0.0 110.13 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -64.77 -43.38 93.44 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 118.348 -0.834 . . . . 0.0 111.841 -177.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.79 -52.26 65.82 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 119.224 0.92 . . . . 0.0 111.385 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.458 ' CG2' HG23 ' A' ' 30' ' ' VAL . 93.8 t -60.35 -34.27 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 122.439 0.296 . . . . 0.0 110.216 -177.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.4 ttt-85 -72.56 -32.57 66.14 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 125.158 1.383 . . . . 0.0 113.124 176.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.22 149.3 50.54 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.957 1.303 . . . . 0.0 113.887 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.57 -23.21 34.57 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.781 1.233 . . . . 0.0 113.162 -177.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.77 -14.67 24.55 Favored Glycine 0 CA--C 1.527 0.807 0 CA-C-N 118.782 0.719 . . . . 0.0 112.538 -177.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -64.95 123.71 20.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 118.304 1.052 . . . . 0.0 109.214 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.07 -31.94 69.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.248 175.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 t -60.62 129.41 23.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 176.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.4 HD12 HG13 ' A' ' 65' ' ' VAL . 1.1 pp -114.69 -24.43 3.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 124.075 0.859 . . . . 0.0 110.603 178.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -129.68 137.84 50.84 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.646 1.112 . . . . 0.0 109.685 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.59 HG11 ' HB1' ' A' ' 16' ' ' ALA . 23.6 t -140.6 148.39 22.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 175.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 42.1 p -105.56 160.32 15.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.133 0.492 . . . . 0.0 111.324 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -129.25 123.08 31.03 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 104.347 -2.464 . . . . 0.0 104.347 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.0 mmtm -100.49 176.66 5.27 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 127.407 2.283 . . . . 0.0 105.921 177.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -115.82 153.62 31.15 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -137.74 152.96 49.75 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 128.991 2.916 . . . . 0.0 105.86 175.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 12.87 -80.33 0.0 OUTLIER Glycine 0 C--N 1.339 0.737 0 C-N-CA 128.038 2.732 . . . . 0.0 115.67 175.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.9 p -129.8 23.91 5.37 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.515 1.126 . . . . 0.0 113.569 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.0 t -151.21 171.63 17.1 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -176.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 12.3 mm -92.93 139.61 17.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 C-N-CA 125.898 1.679 . . . . 0.0 107.439 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.6 m -131.48 153.93 81.73 Favored Pre-proline 0 N--CA 1.472 0.628 0 C-N-CA 124.436 1.094 . . . . 0.0 111.387 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.33 153.71 50.78 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 121.736 1.624 . . . . 0.0 109.491 175.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.69 -142.62 6.97 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 125.484 1.516 . . . . 0.0 110.744 177.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -72.73 165.39 24.9 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.841 1.256 . . . . 0.0 109.755 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.456 ' HB3' HG13 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -145.08 165.1 29.21 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 125.772 1.629 . . . . 0.0 110.809 177.087 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.6 173.78 42.01 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-O 122.731 1.184 . . . . 0.0 112.962 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.46 7.47 5.34 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.484 2.314 . . . . 0.0 110.093 176.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -133.03 127.04 33.21 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 103.422 -2.807 . . . . 0.0 103.422 -175.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -84.43 -15.99 44.22 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 115.611 1.708 . . . . 0.0 115.611 -175.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -58.7 -40.19 82.92 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 121.959 2.163 . . . . 0.0 109.937 176.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -60.47 -30.58 69.77 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.767 0.427 . . . . 0.0 111.039 175.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -69.66 -36.12 75.77 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.539 -0.726 . . . . 0.0 109.652 178.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.5 mm -62.87 -46.95 95.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -63.6 -35.96 82.23 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.863 1.665 . . . . 0.0 111.926 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.0 -22.98 65.04 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 124.716 1.207 . . . . 0.0 114.049 177.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.9 m -64.23 113.99 3.94 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 119.377 0.989 . . . . 0.0 108.83 -178.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.254 2.3 p -103.36 154.85 18.96 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.495 1.118 . . . . 0.0 108.168 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -41.48 -74.76 0.03 OUTLIER 'General case' 0 C--O 1.234 0.272 0 N-CA-C 117.943 2.572 . . . . 0.0 117.943 -174.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -106.17 -36.14 6.99 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -175.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.7 m -53.75 132.16 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 123.235 0.614 . . . . 0.0 110.265 -175.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.51 123.11 46.3 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 -177.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 32.7 tp -122.42 176.11 6.07 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 127.023 2.129 . . . . 0.0 111.284 -174.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -136.48 151.76 49.81 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.49 0.716 . . . . 0.0 110.233 176.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -142.92 123.42 13.99 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.739 0.815 . . . . 0.0 111.295 175.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.42 ' CD1' HG13 ' A' ' 108' ' ' VAL . 40.2 t80 -88.41 123.88 33.4 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 104.65 -2.352 . . . . 0.0 104.65 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.407 HG21 HD13 ' A' ' 82' ' ' ILE . 44.4 t -134.28 140.54 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-N 118.103 0.41 . . . . 0.0 109.919 -175.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.9 tmm_? -85.42 117.84 24.59 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 175.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -112.23 123.45 50.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 108.696 -175.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.1 m . . . . . 0 N--CA 1.447 -0.579 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 176.258 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.1 m . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -57.09 150.2 17.75 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 123.455 0.702 . . . . 0.0 109.703 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 75.2 mmt-85 -135.4 134.04 39.29 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 175.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.2 t -146.59 139.12 25.11 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 124.461 1.105 . . . . 0.0 108.316 -176.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -142.41 176.63 8.85 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.508 1.523 . . . . 0.0 107.214 177.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -131.52 124.35 29.91 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 -176.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -111.56 114.12 26.98 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 104.108 -2.553 . . . . 0.0 104.108 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.9 tt -82.88 113.15 20.3 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 105.361 -2.088 . . . . 0.0 105.361 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.561 HG23 HD12 ' A' ' 117' ' ' ILE . 3.1 mp -79.4 123.8 36.8 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 N-CA-C 105.458 -2.053 . . . . 0.0 105.458 175.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.8 m -106.4 123.11 47.57 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 101.242 -3.614 . . . . 0.0 101.242 175.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -95.49 124.06 39.34 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.475 HD11 HG21 ' A' ' 97' ' ' THR . 10.5 mm -133.94 81.92 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 N-CA-C 103.696 -2.705 . . . . 0.0 103.696 177.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -44.26 130.47 7.09 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 107.986 -2.046 . . . . 0.0 107.986 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -56.0 -10.64 0.84 Allowed 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -83.21 -28.17 29.45 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 117.576 -1.202 . . . . 0.0 110.804 177.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.7 p -71.03 133.53 31.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 120.744 1.611 . . . . 0.0 109.064 -177.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 42.5 t -146.31 176.18 9.96 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.84 1.656 . . . . 0.0 107.011 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.65 -157.2 53.52 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 95' ' ' ALA . 5.1 tt -60.23 -30.98 69.76 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-O 118.049 -0.977 . . . . 0.0 112.047 -175.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -58.17 -45.15 87.98 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 120.304 1.411 . . . . 0.0 110.109 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -36.25 76.98 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 175.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.421 ' HB3' ' HA ' ' A' ' 92' ' ' LEU . . . -62.32 -23.57 66.82 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.084 -0.96 . . . . 0.0 112.573 177.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -56.19 -54.35 46.25 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-N 119.919 1.236 . . . . 0.0 108.861 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.475 HG21 HD11 ' A' ' 85' ' ' ILE . 54.0 m -52.28 -40.41 61.72 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 175.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -55.4 -24.78 39.22 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-O 118.864 -0.964 . . . . 0.0 115.415 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.2 m -115.7 -6.64 12.15 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.184 1.492 . . . . 0.0 112.201 176.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -103.91 -23.46 13.36 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 125.733 1.613 . . . . 0.0 111.974 -175.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.4 mtmp? -53.31 -29.88 36.0 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.44 1.473 . . . . 0.0 111.981 176.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -63.69 -36.83 85.15 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.942 0.897 . . . . 0.0 111.137 176.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 18.1 mt -64.81 -62.27 1.67 Allowed 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 125.363 1.465 . . . . 0.0 108.723 -176.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.409 ' H ' HG12 ' A' ' 104' ' ' VAL 0.264 0.9 OUTLIER -61.14 -28.1 43.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.472 176.354 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 34.1 tttm -62.14 -40.56 96.35 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 121.246 1.839 . . . . 0.0 109.43 175.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -57.51 -24.51 56.33 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.687 1.13 . . . . 0.0 112.253 177.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.63 HG11 ' HB3' ' A' ' 13' ' ' CYS . 55.3 t -84.62 -63.24 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 175.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.42 HG13 ' CD1' ' A' ' 64' ' ' PHE . 87.1 t -65.22 26.46 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.873 1 C-N-CA 132.289 4.236 . . . . 0.0 113.644 -175.612 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -54.12 -27.05 30.81 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 119.314 -2.116 . . . . 0.0 114.035 -175.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -90.78 79.86 5.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 175.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -148.58 176.32 10.43 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 122.375 0.27 . . . . 0.0 110.591 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.42 -59.29 2.02 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.982 0.913 . . . . 0.0 111.04 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -147.54 171.94 14.77 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 125.335 1.454 . . . . 0.0 110.248 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -123.51 134.02 53.93 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -107.1 144.37 33.89 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 104.998 -2.223 . . . . 0.0 104.998 -174.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.6 t -104.0 123.54 57.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 175.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.561 HD12 HG23 ' A' ' 82' ' ' ILE . 98.9 mt -129.08 137.25 57.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 106.225 -1.768 . . . . 0.0 106.225 -175.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.5 p -142.69 -4.01 0.98 Allowed 'General case' 0 C--O 1.239 0.528 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -175.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -146.82 152.13 38.24 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.103 1.361 . . . . 0.0 109.229 -175.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -60.11 -36.17 76.85 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 117.313 -1.327 . . . . 0.0 112.361 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -63.08 -37.45 87.27 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 121.273 1.851 . . . . 0.0 110.584 176.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -68.13 -23.17 64.86 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.108 2.163 . . . . 0.0 111.485 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -84.82 -23.37 29.13 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.256 1.822 . . . . 0.0 113.349 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -59.35 125.76 24.9 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 120.102 1.319 . . . . 0.0 112.12 -175.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -56.9 -27.93 61.33 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.254 -0.904 . . . . 0.0 113.316 176.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -54.59 -60.68 3.03 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 123.575 0.75 . . . . 0.0 111.249 -177.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -80.56 -24.22 39.39 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 117.769 -1.572 . . . . 0.0 109.017 -175.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 27.8 mt -54.47 -47.34 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 175.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -54.09 -49.89 68.07 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 118.78 0.718 . . . . 0.0 112.038 175.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.8 t -71.91 -29.16 64.02 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.598 0.635 . . . . 0.0 111.661 -176.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -72.11 -47.14 53.43 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 119.301 0.955 . . . . 0.0 109.165 176.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 78.0 mt -60.17 -36.95 78.73 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 175.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.0 mtmt -61.68 -53.21 59.21 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 175.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? -57.05 -45.77 82.96 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.976 1.262 . . . . 0.0 111.209 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 CA-C-O 117.964 -1.017 . . . . 0.0 112.873 179.145 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.433 ' HB ' HD11 ' A' ' 103' ' ' LEU . 3.2 m -142.6 162.07 36.42 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.565 1.946 . . . . 0.0 106.621 -176.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.1 mtpt -131.62 -173.06 3.02 Favored 'General case' 0 CA--C 1.516 -0.328 0 O-C-N 121.316 -0.865 . . . . 0.0 111.303 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.13 148.38 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 C-N-CA 126.908 2.083 . . . . 0.0 105.654 175.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -88.31 74.05 8.74 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 101.9 -3.37 . . . . 0.0 101.9 175.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.85 -44.61 59.52 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 125.391 1.477 . . . . 0.0 112.875 -174.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -65.47 -49.34 69.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.083 0.856 . . . . 0.0 109.738 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.56 -34.39 74.11 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.322 -0.861 . . . . 0.0 112.0 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.5 m -74.78 -38.02 62.27 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.451 178.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.2 ttm180 -59.95 -27.25 66.65 Favored 'General case' 0 C--N 1.342 0.263 0 CA-C-O 116.975 -1.488 . . . . 0.0 111.17 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.06 -60.78 3.24 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 120.089 1.313 . . . . 0.0 110.465 176.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.445 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -62.38 -40.2 95.66 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.013 0.824 . . . . 0.0 111.073 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -58.77 -36.34 74.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.545 176.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -62.19 -44.96 95.41 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 119.925 1.239 . . . . 0.0 110.604 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.6 mp -56.68 -61.84 2.14 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 175.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.418 ' CG2' HG23 ' A' ' 30' ' ' VAL . 42.3 t -58.21 -34.44 49.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 O-C-N 121.742 -0.599 . . . . 0.0 111.498 -176.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.2 ttt-85 -67.71 -38.16 83.25 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 124.683 1.193 . . . . 0.0 111.213 175.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -66.56 137.07 56.5 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.891 0.876 . . . . 0.0 108.737 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.6 -11.06 57.8 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 125.279 1.432 . . . . 0.0 111.373 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -98.45 5.85 60.82 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.724 1.63 . . . . 0.0 112.225 175.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -85.63 141.55 29.72 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.248 1.524 . . . . 0.0 109.936 176.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -80.28 -29.0 38.24 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 175.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.9 t -73.62 125.03 32.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 175.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 pp -115.16 -24.49 3.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.816 1.246 . . . . 0.0 111.312 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.0 p-90 -125.38 145.21 50.15 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 119.224 0.92 . . . . 0.0 108.777 177.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.445 HG21 ' HB1' ' A' ' 16' ' ' ALA . 6.1 t -135.71 158.84 39.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 127.389 2.276 . . . . 0.0 106.151 176.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.449 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 42.0 p -119.15 154.5 33.19 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -126.69 123.58 37.85 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 176.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -107.04 176.72 5.08 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.171 2.188 . . . . 0.0 105.347 -175.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -116.94 155.53 28.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.485 0.659 . . . . 0.0 109.509 176.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -142.26 166.71 23.94 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 127.306 2.242 . . . . 0.0 105.906 175.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 14.07 -88.78 0.0 OUTLIER Glycine 0 CA--C 1.531 1.06 0 C-N-CA 128.385 2.898 . . . . 0.0 114.988 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 p -135.59 44.17 2.55 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 126.24 1.816 . . . . 0.0 109.312 175.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -155.1 174.29 15.39 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -176.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.3 mm -103.47 139.55 24.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 126.22 1.808 . . . . 0.0 106.968 175.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 16.6 m -135.66 160.54 67.25 Favored Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 124.98 1.312 . . . . 0.0 110.902 -178.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.87 149.11 53.15 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.525 2.15 . . . . 0.0 110.444 175.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -115.43 -145.95 8.72 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 126.706 2.098 . . . . 0.0 109.676 175.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -70.26 164.65 23.92 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -144.95 168.64 19.76 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.849 1.26 . . . . 0.0 108.49 175.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.81 174.92 46.91 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-O 121.88 0.711 . . . . 0.0 113.076 -177.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.64 -26.07 8.81 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.693 1.997 . . . . 0.0 110.691 176.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.02 129.18 55.45 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 -176.116 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -83.94 -8.5 59.15 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.404 1.261 . . . . 0.0 114.404 -174.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -58.56 -40.12 82.18 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 119.497 -2.002 . . . . 0.0 109.048 175.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -66.48 -22.54 66.19 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.597 -0.689 . . . . 0.0 111.601 176.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -66.61 -36.25 82.14 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-N 119.472 1.033 . . . . 0.0 109.801 176.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.9 mm -60.02 -39.7 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -72.7 -23.35 60.86 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.849 1.66 . . . . 0.0 113.313 175.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -73.97 -24.92 59.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 120.79 1.632 . . . . 0.0 110.036 175.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 79.9 m -71.56 159.37 34.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.598 -0.689 . . . . 0.0 109.432 176.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.629 ' OG1' HG22 ' A' ' 59' ' ' VAL . 16.7 p -132.63 -174.33 3.43 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.73 1.212 . . . . 0.0 112.644 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -77.01 -67.46 0.71 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.304 1.442 . . . . 0.0 108.448 175.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -106.45 -27.92 10.64 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 -175.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.629 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -65.58 167.77 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-N 121.997 2.18 . . . . 0.0 113.428 -175.162 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.2 124.87 45.74 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 175.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 56.2 tp -129.02 159.09 37.02 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 126.171 1.788 . . . . 0.0 107.962 -175.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -123.81 157.82 33.21 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.449 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -147.2 141.62 26.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 118.126 0.421 . . . . 0.0 111.319 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -106.54 123.58 48.31 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 176.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.2 t -135.62 138.15 48.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.834 0.826 . . . . 0.0 112.136 -175.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.5 ttm-85 -79.33 117.71 20.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 128.388 2.675 . . . . 0.0 107.15 175.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -136.18 167.75 20.69 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.7 m . . . . . 0 C--N 1.327 -0.401 0 O-C-N 120.8 -1.187 . . . . 0.0 107.804 175.985 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 75.3 m . . . . . 0 N--CA 1.442 -0.827 0 N-CA-C 103.76 -2.681 . . . . 0.0 103.76 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -64.37 158.5 23.47 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.661 -176.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.9 mtt180 -116.61 170.87 8.25 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.7 t -145.64 124.3 12.54 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 175.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -116.64 123.35 47.07 Favored 'General case' 0 CA--C 1.5 -0.979 0 C-N-CA 125.753 1.621 . . . . 0.0 107.361 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -86.31 131.46 34.21 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.713 -1.131 . . . . 0.0 108.683 -178.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.68 122.19 45.56 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -95.21 113.22 24.88 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 101.029 -3.693 . . . . 0.0 101.029 174.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -97.41 143.17 13.05 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 -176.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.7 m -126.18 123.5 38.37 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 175.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.3 t-105 -100.85 128.09 47.03 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 104.021 -2.585 . . . . 0.0 104.021 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.426 HD11 HG21 ' A' ' 97' ' ' THR . 7.5 mt -132.27 103.03 6.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 104.27 -2.492 . . . . 0.0 104.27 176.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.43 ' O ' HG12 ' A' ' 89' ' ' VAL . . . -48.7 138.09 15.18 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 176.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -66.62 -7.22 18.93 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.747 -1.443 . . . . 0.0 111.953 -176.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -85.45 -34.78 21.58 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 117.188 -1.387 . . . . 0.0 113.072 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.43 HG12 ' O ' ' A' ' 86' ' ' GLY . 3.2 p -64.39 124.1 18.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 120.941 1.701 . . . . 0.0 109.863 -175.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.8 t -65.82 162.13 19.5 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 122.616 1.198 . . . . 0.0 113.262 -175.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.02 -30.07 72.55 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 125.32 1.438 . . . . 0.0 113.715 -176.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.7 -46.95 87.5 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 118.478 1.139 . . . . 0.0 108.355 175.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -67.48 -41.96 83.71 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 123.171 0.588 . . . . 0.0 109.526 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -58.74 -24.95 62.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.739 0.7 . . . . 0.0 110.408 175.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.97 -39.17 93.87 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.061 -1.024 . . . . 0.0 110.531 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.65 -41.53 77.36 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 118.979 0.809 . . . . 0.0 108.849 176.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.426 HG21 HD11 ' A' ' 85' ' ' ILE . 3.4 m -59.1 -30.25 67.97 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.636 -176.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -70.88 -26.38 74.08 Favored Glycine 0 CA--C 1.532 1.128 0 CA-C-N 119.739 1.154 . . . . 0.0 112.448 175.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 33.5 m -89.48 -10.92 44.54 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.425 1.49 . . . . 0.0 109.974 175.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -103.46 -27.82 12.16 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.422 -0.799 . . . . 0.0 111.375 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -53.5 -51.94 61.18 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 119.767 1.167 . . . . 0.0 109.745 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -58.67 -34.62 71.46 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 123.455 0.702 . . . . 0.0 110.88 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.433 HD11 ' HB ' ' A' ' 6' ' ' THR . 14.8 mt -64.09 -62.39 1.66 Allowed 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 124.014 0.926 . . . . 0.0 110.074 178.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.253 0.9 OUTLIER -60.32 -25.72 34.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 118.481 -1.288 . . . . 0.0 110.224 176.503 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -67.92 -26.41 65.96 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 120.534 1.515 . . . . 0.0 109.729 175.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.68 -25.98 68.45 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.957 1.708 . . . . 0.0 110.729 175.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 79.0 t -86.16 -58.01 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 175.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 60.7 t -73.4 26.32 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 130.358 3.463 . . . . 0.0 111.695 -175.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.43 -26.19 64.97 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 119.814 -1.804 . . . . 0.0 111.261 -176.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -91.94 70.91 5.55 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 175.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.13 175.94 8.94 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.044 0.449 . . . . 0.0 111.001 176.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.85 -66.33 0.94 Allowed 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 108.696 -0.854 . . . . 0.0 108.696 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.97 175.08 13.44 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 128.343 2.657 . . . . 0.0 107.233 175.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -100.52 178.5 4.71 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 124.509 1.124 . . . . 0.0 112.692 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -143.43 144.54 32.07 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 103.712 -2.699 . . . . 0.0 103.712 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 57.5 t -123.22 131.12 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 175.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -129.64 147.99 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 126.551 1.94 . . . . 0.0 109.335 -175.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.3 p -146.02 9.42 1.13 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.507 1.123 . . . . 0.0 113.08 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -142.51 147.11 35.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -178.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -62.59 -24.22 67.45 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 119.777 1.172 . . . . 0.0 110.213 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -68.34 -55.05 13.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 175.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -56.73 -23.48 42.84 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.706 1.602 . . . . 0.0 111.073 175.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -79.68 -22.84 42.96 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.491 1.916 . . . . 0.0 113.482 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -60.22 124.77 21.29 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 119.488 1.04 . . . . 0.0 112.667 -177.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.406 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 11.9 mm-40 -58.27 -26.71 63.29 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 176.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -48.71 -66.32 0.42 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.181 1.792 . . . . 0.0 111.182 177.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -78.19 -21.76 49.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 117.077 -1.849 . . . . 0.0 108.768 -176.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.406 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 72.6 mt -55.13 -43.02 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 120.03 1.286 . . . . 0.0 107.793 176.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -54.18 -54.07 44.76 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 119.709 1.14 . . . . 0.0 111.393 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 47.5 t -67.19 -36.28 81.42 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.785 0.721 . . . . 0.0 111.103 -177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -61.7 -48.86 78.85 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.048 1.339 . . . . 0.0 109.402 176.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.68 -36.42 83.78 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.284 177.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -61.54 -55.55 29.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 175.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -56.01 -52.2 65.05 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 127.333 2.253 . . . . 0.0 111.5 -178.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.399 0 O-C-N 121.393 -0.817 . . . . 0.0 111.798 178.348 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.414 0 CA-C-O 123.203 1.478 . . . . 0.0 110.043 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.7 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.4 m -96.27 171.24 8.71 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 127.463 2.305 . . . . 0.0 105.597 175.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.4 tttp -138.85 -170.95 2.97 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 120.787 -1.196 . . . . 0.0 111.268 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -140.2 151.36 21.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 124.342 1.057 . . . . 0.0 111.193 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -95.44 79.05 3.42 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 101.37 -3.567 . . . . 0.0 101.37 174.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -58.63 -33.08 69.64 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 116.569 -1.681 . . . . 0.0 112.188 -175.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -73.54 -54.32 8.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 119.283 0.947 . . . . 0.0 109.199 -176.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.67 -35.5 76.4 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 119.529 -0.272 . . . . 0.0 111.011 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.46 ' HB3' HG11 ' A' ' 107' ' ' VAL . 77.6 m -76.74 -32.3 57.68 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 117.811 -1.09 . . . . 0.0 110.819 175.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.78 -37.96 77.46 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 116.326 -1.797 . . . . 0.0 108.621 177.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.7 -61.62 2.19 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 119.521 1.055 . . . . 0.0 108.966 -177.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.461 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -68.12 -33.82 75.22 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.612 -0.68 . . . . 0.0 111.236 -176.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -59.32 -38.59 80.66 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.417 0.687 . . . . 0.0 110.239 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -66.06 -45.06 82.67 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 124.636 1.175 . . . . 0.0 109.04 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -54.69 -57.52 11.17 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 118.716 0.689 . . . . 0.0 109.267 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.6 t -61.07 -24.07 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 123.085 0.554 . . . . 0.0 112.335 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 -45.03 15.52 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 121.177 -0.952 . . . . 0.0 109.474 175.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -51.53 123.33 9.64 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 126.66 1.984 . . . . 0.0 110.943 -175.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -73.41 -9.87 59.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.489 -176.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.46 -8.09 50.24 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-O 118.914 -0.937 . . . . 0.0 112.576 175.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.6 t -68.39 148.03 51.25 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 118.744 1.272 . . . . 0.0 111.176 -175.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.13 -36.03 19.82 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.051 -1.432 . . . . 0.0 107.185 174.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.7 t -68.91 123.89 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.91 -24.46 3.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 124.392 1.077 . . . . 0.0 110.642 177.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -121.59 142.45 50.09 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.866 1.266 . . . . 0.0 108.179 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.461 HG21 ' HB1' ' A' ' 16' ' ' ALA . 7.3 t -137.98 160.19 33.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 126.606 1.962 . . . . 0.0 106.652 176.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 76.9 p -126.75 156.87 40.5 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 175.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -129.83 130.94 45.92 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.0 mmmt -103.8 176.1 5.26 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -123.88 139.79 53.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 176.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -131.54 123.3 27.69 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 175.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 47.31 -100.85 0.03 OUTLIER Glycine 0 CA--C 1.525 0.691 0 C-N-CA 124.606 1.098 . . . . 0.0 112.105 -176.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.3 p -120.23 42.72 2.89 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.617 1.167 . . . . 0.0 111.91 177.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.2 t -152.83 160.69 43.1 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.799 1.181 . . . . 0.0 111.4 175.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 21.3 mm -90.79 136.33 24.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.406 ' HB ' ' HD2' ' A' ' 41' ' ' PRO . 3.2 m -131.63 163.58 48.75 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 124.493 1.117 . . . . 0.0 109.976 178.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.406 ' HD2' ' HB ' ' A' ' 40' ' ' VAL . 73.0 Cg_endo -69.97 164.63 34.05 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.017 1.811 . . . . 0.0 111.242 175.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.1 -146.92 5.79 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 126.312 1.911 . . . . 0.0 108.856 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.81 161.12 26.89 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.878 1.271 . . . . 0.0 110.852 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.27 153.78 36.75 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.307 1.843 . . . . 0.0 110.266 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 174.5 -172.28 45.26 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-N 119.209 0.913 . . . . 0.0 113.279 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.69 -20.47 10.09 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 126.28 1.832 . . . . 0.0 113.002 -176.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -109.18 123.09 48.66 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 -176.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -82.35 -6.62 59.38 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.257 0.623 . . . . 0.0 112.49 -175.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -57.31 -29.29 63.8 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 120.83 -1.169 . . . . 0.0 112.7 177.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -74.6 -36.2 62.97 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.201 1.0 . . . . 0.0 111.239 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -56.76 -40.98 76.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 126.837 2.055 . . . . 0.0 109.087 -176.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.8 mm -55.57 -44.04 74.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 124.043 0.937 . . . . 0.0 108.583 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -85.43 -27.77 25.53 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.229 1.012 . . . . 0.0 111.988 -178.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -63.56 -27.26 69.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 118.323 -0.846 . . . . 0.0 111.259 176.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 75.4 m -60.8 120.45 10.14 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.252 2.1 p -83.96 158.94 21.37 Favored 'General case' 0 N--CA 1.437 -1.078 0 C-N-CA 125.339 1.455 . . . . 0.0 108.992 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -50.41 -73.77 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 126.668 1.987 . . . . 0.0 115.499 -175.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -105.83 -36.49 7.0 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.161 1.385 . . . . 0.0 113.703 -175.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.401 HG13 ' H ' ' A' ' 59' ' ' VAL . 1.8 m -60.8 159.86 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.452 0.701 . . . . 0.0 111.857 -175.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.77 151.04 23.52 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.197 0.599 . . . . 0.0 109.443 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.8 tp -150.6 168.04 25.47 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.383 1.473 . . . . 0.0 108.494 -176.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -131.58 154.95 48.32 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.079 0.551 . . . . 0.0 109.688 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -147.36 167.52 24.12 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 123.453 0.701 . . . . 0.0 112.339 176.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -141.09 123.28 15.65 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.8 t -136.12 130.79 48.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.03 114.14 16.61 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 176.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -118.24 170.75 8.63 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 124.36 1.064 . . . . 0.0 108.641 -175.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 89.8 m . . . . . 0 N--CA 1.45 -0.465 0 O-C-N 120.451 -1.406 . . . . 0.0 110.558 -175.898 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.237 0.433 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.9 mtmt -61.46 160.08 11.67 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.4 0.619 . . . . 0.0 110.522 176.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 -123.48 158.74 30.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 175.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.1 t -146.16 137.39 24.6 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 175.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -140.34 123.89 17.08 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -87.89 141.17 28.8 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.5 114.72 23.88 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.085 1.354 . . . . 0.0 109.282 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.33 113.57 21.24 Favored 'General case' 0 C--O 1.225 -0.237 0 N-CA-C 103.664 -2.717 . . . . 0.0 103.664 175.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.2 mt -105.31 142.66 17.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 m -126.27 123.57 38.4 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 175.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.7 t-105 -90.29 123.44 34.06 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 103.798 -2.668 . . . . 0.0 103.798 175.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 4.7 mm -137.56 86.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 103.563 -2.754 . . . . 0.0 103.563 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.76 147.36 6.89 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -178.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -54.29 -21.82 10.28 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.897 0.702 . . . . 0.0 112.897 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -83.12 -34.76 26.01 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 117.321 -1.323 . . . . 0.0 112.078 -175.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.82 136.09 26.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 120.489 1.495 . . . . 0.0 109.88 -178.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.7 t -145.82 176.71 9.46 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 127.125 2.17 . . . . 0.0 107.396 -176.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.72 -156.81 53.52 Favored Glycine 0 N--CA 1.45 -0.405 0 CA-C-O 121.535 0.519 . . . . 0.0 112.148 175.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 tt -51.63 -36.78 47.39 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.799 1.24 . . . . 0.0 111.269 -176.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.4 mp0 -63.7 -35.68 81.35 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 119.565 1.075 . . . . 0.0 112.141 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -76.06 -49.72 16.71 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 175.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.22 -29.21 63.55 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.299 1.44 . . . . 0.0 113.296 -175.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -48.47 -37.74 18.19 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 119.778 1.172 . . . . 0.0 111.415 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 20.3 m -58.16 -32.28 68.04 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.889 0.768 . . . . 0.0 111.893 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.24 -25.97 72.46 Favored Glycine 0 CA--C 1.53 0.985 0 O-C-N 120.86 -1.15 . . . . 0.0 112.34 177.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.5 m -105.75 -16.69 14.6 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.489 1.915 . . . . 0.0 111.633 -176.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -103.95 -25.85 12.87 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 126.086 1.754 . . . . 0.0 112.073 -175.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 19.3 mtmt -56.67 -26.65 56.96 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.453 1.479 . . . . 0.0 112.311 175.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -62.3 -38.31 88.88 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 118.942 0.792 . . . . 0.0 109.84 176.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.7 HD11 ' HB ' ' A' ' 6' ' ' THR . 39.6 mt -68.88 -61.41 1.81 Allowed 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 125.849 1.66 . . . . 0.0 109.576 -176.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.286 1.4 p -55.89 -30.87 29.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 118.052 -0.975 . . . . 0.0 108.514 176.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.55 -39.06 93.43 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 120.626 1.557 . . . . 0.0 109.617 175.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -54.95 -29.04 55.66 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 121.487 1.949 . . . . 0.0 111.701 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.46 HG11 ' HB3' ' A' ' 13' ' ' CYS . 79.7 t -86.1 -52.35 12.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 119.258 0.935 . . . . 0.0 109.227 175.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.2 t -79.21 14.82 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 129.432 3.093 . . . . 0.0 115.116 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -55.72 -26.21 44.17 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 122.381 2.355 . . . . 0.0 112.866 -176.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -84.85 63.7 8.19 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 175.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -137.47 176.4 8.74 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.674 0.789 . . . . 0.0 109.52 176.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.93 -66.38 1.0 Allowed 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 124.096 0.873 . . . . 0.0 110.216 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -148.26 176.21 10.44 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.818 1.647 . . . . 0.0 109.614 -176.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -121.37 171.94 8.4 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 125.021 1.328 . . . . 0.0 111.467 -177.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -145.61 147.98 32.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 17.2 t -126.32 125.68 67.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 175.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.3 mt -121.79 143.93 32.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 125.979 1.712 . . . . 0.0 109.214 -175.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.9 p -137.42 1.39 2.39 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -142.87 153.43 43.14 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -177.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -62.52 -38.74 91.14 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.719 0.69 . . . . 0.0 110.237 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -61.47 -45.28 94.94 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 119.091 0.859 . . . . 0.0 109.232 175.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -62.47 -23.94 67.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.813 1.245 . . . . 0.0 111.011 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -83.68 -23.86 31.54 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.074 1.75 . . . . 0.0 113.02 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -62.65 124.07 20.02 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.75 0.705 . . . . 0.0 112.127 -175.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.71 -26.07 66.88 Favored 'General case' 0 CA--C 1.527 0.077 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -56.7 -45.18 81.98 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -175.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -89.61 -24.42 21.68 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 117.961 -1.019 . . . . 0.0 109.102 178.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 24.8 mt -56.68 -40.92 72.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 N-CA-C 106.65 -1.611 . . . . 0.0 106.65 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.3 mtpm? -53.59 -52.46 59.72 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 118.593 0.633 . . . . 0.0 110.215 175.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 9.2 t -65.64 -37.94 87.96 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.468 0.707 . . . . 0.0 111.108 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -61.4 -53.88 50.82 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.85 1.66 . . . . 0.0 108.934 177.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 76.2 mt -62.0 -34.18 75.71 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 125.103 1.361 . . . . 0.0 110.098 175.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.03 -50.25 74.1 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 120.434 1.47 . . . . 0.0 110.643 175.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt -62.01 -49.65 75.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 120.352 1.433 . . . . 0.0 109.08 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.869 0 C-N-CA 124.227 1.011 . . . . 0.0 111.988 175.729 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.6 m -63.56 157.72 22.97 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.005 1.722 . . . . 0.0 106.644 176.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.96 -173.04 2.66 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 120.668 -1.27 . . . . 0.0 112.021 -175.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.66 149.26 29.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 124.005 0.922 . . . . 0.0 109.413 177.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -94.6 71.08 3.61 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 103.554 -2.758 . . . . 0.0 103.554 175.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -56.67 -34.09 67.03 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-O 117.909 -1.044 . . . . 0.0 111.517 -175.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -70.09 -38.67 75.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 119.828 1.194 . . . . 0.0 110.615 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.81 -49.32 18.41 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 121.827 -0.546 . . . . 0.0 110.057 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.3 m -62.1 -38.02 87.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.699 -0.626 . . . . 0.0 111.56 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -62.49 -31.59 72.37 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 116.289 -1.815 . . . . 0.0 110.327 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.38 -54.38 47.48 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 120.766 1.621 . . . . 0.0 110.727 178.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.492 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -70.59 -40.06 73.47 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.516 -0.74 . . . . 0.0 111.486 -178.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -55.66 -43.01 75.9 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 118.406 -0.807 . . . . 0.0 109.683 176.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -57.54 -45.0 85.61 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.487 1.115 . . . . 0.0 111.043 -177.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mp -59.45 -63.04 1.44 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.324 0.65 . . . . 0.0 110.099 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.5 t -58.35 -30.56 40.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 123.108 0.563 . . . . 0.0 111.84 -176.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.24 -28.2 63.0 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.894 1.277 . . . . 0.0 111.342 175.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -71.18 155.73 40.4 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.682 0.673 . . . . 0.0 109.7 -174.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -86.43 -18.5 31.57 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.954 1.302 . . . . 0.0 113.297 177.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.29 -2.43 38.38 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 125.155 1.359 . . . . 0.0 114.586 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.3 t -69.66 135.34 49.77 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 119.574 1.687 . . . . 0.0 110.407 -178.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.74 -25.52 56.63 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 55.2 t -78.27 123.9 35.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 175.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.2 pp -112.66 -23.7 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.673 1.189 . . . . 0.0 111.155 -176.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 38.2 p-90 -130.05 153.69 48.19 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 122.013 0.911 . . . . 0.0 111.008 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.492 HG21 ' HB1' ' A' ' 16' ' ' ALA . 5.2 t -139.6 165.89 21.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 128.579 2.752 . . . . 0.0 108.622 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 30.9 p -126.0 160.86 28.92 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.487 1.115 . . . . 0.0 109.0 175.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -132.86 126.67 32.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.8 mmmt -109.44 171.5 7.41 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.421 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 49.6 m-85 -121.65 143.68 49.2 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 175.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -139.19 123.54 18.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 35.43 -98.98 0.01 OUTLIER Glycine 0 CA--C 1.532 1.099 0 C-N-CA 126.916 2.198 . . . . 0.0 115.068 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 m -104.4 18.3 22.43 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.253 1.421 . . . . 0.0 113.941 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.2 t -146.37 169.0 19.75 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 120.748 1.613 . . . . 0.0 114.166 -175.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.421 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 17.5 mm -99.21 132.96 43.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 104.39 -2.448 . . . . 0.0 104.39 175.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.3 m -126.16 154.96 74.34 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 175.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.75 162.87 36.85 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 CA-C-N 121.357 1.52 . . . . 0.0 109.565 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.5 -158.63 10.43 Favored Glycine 0 CA--C 1.523 0.575 0 C-N-CA 126.517 2.008 . . . . 0.0 108.69 175.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -60.23 167.59 2.35 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 122.073 0.939 . . . . 0.0 112.694 176.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -138.0 161.64 36.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.752 2.021 . . . . 0.0 110.271 -175.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.42 176.74 43.93 Favored Glycine 0 CA--C 1.527 0.785 0 CA-C-O 122.029 0.794 . . . . 0.0 113.346 178.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -125.77 -3.46 7.15 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.494 1.918 . . . . 0.0 112.042 -176.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -131.22 127.78 38.6 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 127.27 2.228 . . . . 0.0 105.889 -175.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -83.17 -15.85 48.97 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 118.357 -0.83 . . . . 0.0 109.407 -175.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -55.82 -36.31 67.34 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 120.139 1.336 . . . . 0.0 109.595 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -65.63 -29.27 69.82 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 118.406 -0.806 . . . . 0.0 112.015 176.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.426 ' CD1' HD11 ' A' ' 123' ' ' LEU . 1.0 OUTLIER -61.27 -51.67 67.93 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 124.42 1.088 . . . . 0.0 108.936 178.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.8 mp -62.75 -34.7 67.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 O-C-N 121.665 -0.647 . . . . 0.0 109.648 -175.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -73.92 -35.0 64.56 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.131 0.878 . . . . 0.0 111.226 176.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -61.93 -33.42 74.23 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.939 1.296 . . . . 0.0 112.893 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 89.9 m -50.64 121.49 5.89 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.077 0.951 . . . . 0.0 110.337 -176.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 p -84.15 170.69 13.55 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 128.532 2.733 . . . . 0.0 111.798 -176.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 10.2 p-10 -69.9 -76.87 0.09 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.942 2.097 . . . . 0.0 115.957 -174.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.423 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 3.2 t70 -106.51 -30.57 8.98 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 127.106 2.162 . . . . 0.0 112.402 -176.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.5 m -55.18 156.24 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-O 122.966 1.365 . . . . 0.0 111.451 -175.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.0 123.81 48.72 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 176.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.5 tp -129.29 165.98 20.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.628 1.571 . . . . 0.0 109.317 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -132.01 152.25 51.25 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.484 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -138.01 155.05 49.24 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.009 1.324 . . . . 0.0 111.268 177.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -127.9 123.49 35.12 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.956 -2.239 . . . . 0.0 104.956 177.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.1 t -132.5 135.77 57.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -80.48 123.69 28.28 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 175.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -126.25 169.88 12.43 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.929 1.292 . . . . 0.0 108.029 -176.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.446 -0.628 0 O-C-N 120.162 -1.586 . . . . 0.0 108.683 -179.6 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -61.56 151.41 33.23 Favored 'General case' 0 C--N 1.339 0.136 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 177.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -137.47 161.97 34.92 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 103.796 -2.668 . . . . 0.0 103.796 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.1 t -142.05 149.14 39.55 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 176.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -131.15 172.38 12.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -141.69 139.67 33.0 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 177.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -116.47 117.58 30.3 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -176.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.421 HD22 ' O ' ' A' ' 63' ' ' ALA . 1.7 tm? -91.47 113.64 25.96 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 102.138 -3.282 . . . . 0.0 102.138 175.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.3 mp -105.75 125.73 61.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -101.84 123.51 45.9 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 56.0 t-105 -95.33 123.41 38.84 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 104.729 -2.323 . . . . 0.0 104.729 175.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.3 mt -143.92 98.36 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 -179.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -63.32 166.79 24.69 Favored Glycine 0 CA--C 1.534 1.226 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 175.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -77.97 -12.01 59.95 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.344 -1.68 . . . . 0.0 110.628 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -83.07 -27.43 30.27 Favored 'General case' 0 C--O 1.237 0.426 0 O-C-N 120.14 -1.6 . . . . 0.0 112.17 -175.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.3 p -67.43 123.85 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 104.75 -2.315 . . . . 0.0 104.75 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.7 t -66.23 158.73 28.13 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 122.203 1.001 . . . . 0.0 111.4 -175.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.92 -24.43 49.81 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.411 1.482 . . . . 0.0 113.196 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 9.8 tt -67.99 -50.79 53.5 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-N 119.354 1.577 . . . . 0.0 109.641 176.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -63.96 -43.65 95.16 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 176.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 42.3 ttp85 -55.09 -35.81 64.98 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 118.391 0.541 . . . . 0.0 111.249 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.63 -26.62 65.63 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 118.025 -0.988 . . . . 0.0 111.888 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -57.15 -39.47 75.27 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 121.115 1.78 . . . . 0.0 111.371 175.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 38.1 m -55.5 -28.22 53.31 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 119.948 1.249 . . . . 0.0 110.99 175.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.44 -20.58 67.84 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.409 1.481 . . . . 0.0 114.406 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 92.4 m -120.9 -6.96 9.55 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.909 1.284 . . . . 0.0 110.89 176.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -104.19 -24.96 13.1 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-O 118.247 -0.882 . . . . 0.0 113.169 -175.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -58.63 -24.04 60.28 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 121.248 1.84 . . . . 0.0 111.434 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -69.65 -41.25 75.82 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 120.197 1.362 . . . . 0.0 108.608 175.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 25.4 mt -57.5 -63.04 1.37 Allowed 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 126.193 1.797 . . . . 0.0 111.408 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.429 HG12 ' H ' ' A' ' 104' ' ' VAL . 0.9 OUTLIER -59.53 -29.65 42.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.059 176.142 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -72.14 -25.06 61.56 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-O 116.882 -1.532 . . . . 0.0 111.714 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -61.64 -38.53 88.03 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 122.061 2.209 . . . . 0.0 109.713 175.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 98.9 t -72.97 -60.37 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 175.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 39.3 t -77.79 26.45 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 129.153 2.981 . . . . 0.0 112.927 -175.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -57.19 -26.36 60.51 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 119.713 -1.867 . . . . 0.0 110.751 -177.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -84.3 72.49 10.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.92 1.288 . . . . 0.0 107.854 175.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -145.03 174.63 10.87 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 122.826 0.45 . . . . 0.0 110.878 176.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.35 -66.2 0.93 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 118.507 -0.759 . . . . 0.0 109.865 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.38 176.41 11.71 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.702 2.001 . . . . 0.0 108.721 178.095 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -106.4 173.5 6.29 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 123.568 0.747 . . . . 0.0 112.204 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.47 ' CD1' HD11 ' A' ' 117' ' ' ILE . 0.7 OUTLIER -143.4 155.04 44.29 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 103.126 -2.916 . . . . 0.0 103.126 -179.9 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 14.7 t -131.84 129.52 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 O-C-N 120.61 -1.306 . . . . 0.0 107.679 175.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.47 HD11 ' CD1' ' A' ' 115' ' ' PHE . 2.6 mp -133.97 148.1 30.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 125.509 1.524 . . . . 0.0 107.835 -178.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 7.7 p -130.85 -8.45 3.97 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.454 1.902 . . . . 0.0 113.966 -176.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -124.22 124.27 42.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -176.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.9 ttp85 -60.17 -30.56 69.41 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.316 -178.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -74.66 -26.18 59.69 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 119.83 1.195 . . . . 0.0 111.909 175.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.31 -40.54 43.95 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -177.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.426 HD11 ' CD1' ' A' ' 51' ' ' PHE . 2.3 tm? -45.18 -23.32 0.16 Allowed 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 130.195 3.398 . . . . 0.0 116.279 -175.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -48.15 130.54 15.88 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 125.476 1.51 . . . . 0.0 111.782 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -56.12 -16.48 5.19 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 176.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.262 30.2 t70 -58.1 -56.42 22.31 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 117.565 -1.207 . . . . 0.0 112.988 -175.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -77.09 -26.36 53.32 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 116.459 -2.096 . . . . 0.0 107.608 -175.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 51.4 mt -55.72 -40.84 62.77 Favored 'Isoleucine or valine' 0 C--N 1.343 0.302 0 C-N-CA 124.836 1.254 . . . . 0.0 108.331 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.2 mtmm -54.35 -52.17 62.43 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.915 0.779 . . . . 0.0 110.438 175.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 47.5 t -63.93 -44.25 93.43 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 117.962 -1.018 . . . . 0.0 109.47 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -63.85 -40.54 96.82 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.731 1.605 . . . . 0.0 110.687 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.44 -32.68 74.42 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.754 0.821 . . . . 0.0 109.358 175.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 46.3 mmtt -76.31 -38.53 55.9 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.412 1.485 . . . . 0.0 112.083 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -59.86 -57.24 13.73 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 125.998 1.719 . . . . 0.0 106.79 175.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.501 0 C-N-CA 123.461 0.705 . . . . 0.0 112.582 175.86 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 121.85 0.833 . . . . 0.0 111.533 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.634 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.8 m -111.9 171.92 7.21 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 128.06 2.544 . . . . 0.0 106.298 176.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.7 mmtp -140.48 178.99 6.92 Favored 'General case' 0 CA--C 1.513 -0.446 0 O-C-N 121.219 -0.926 . . . . 0.0 111.332 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.401 ' H ' HD13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -126.23 150.49 31.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 124.58 1.152 . . . . 0.0 109.441 179.243 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -95.05 83.42 3.93 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 101.759 -3.423 . . . . 0.0 101.759 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -61.99 -29.36 70.2 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 117.324 -1.322 . . . . 0.0 112.93 -175.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -69.09 -59.22 3.18 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.629 1.104 . . . . 0.0 108.346 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.62 95.68 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 122.667 0.387 . . . . 0.0 111.276 -176.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 85.7 m -73.97 -33.21 63.79 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.56 -0.733 . . . . 0.0 110.781 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.7 ttt-85 -63.92 -37.1 86.17 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 116.979 -1.486 . . . . 0.0 108.53 175.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.75 -46.91 87.71 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 120.351 1.432 . . . . 0.0 110.679 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.469 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -61.26 -50.78 71.67 Favored 'General case' 0 N--CA 1.462 0.137 0 O-C-N 121.553 -0.717 . . . . 0.0 111.523 176.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -51.39 -47.53 62.87 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.581 0.752 . . . . 0.0 110.293 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.89 -49.55 77.24 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.417 1.887 . . . . 0.0 111.0 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mp -59.52 -51.14 71.14 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 120.275 1.398 . . . . 0.0 111.205 175.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.415 ' CG2' HG23 ' A' ' 30' ' ' VAL . 79.2 t -60.93 -30.4 47.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 O-C-N 121.741 -0.599 . . . . 0.0 110.033 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.15 -38.74 60.87 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.375 1.07 . . . . 0.0 112.973 175.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -67.46 123.36 20.18 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -175.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.67 -32.16 68.85 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 124.666 1.186 . . . . 0.0 112.205 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.0 -11.47 82.51 Favored Glycine 0 CA--C 1.526 0.757 0 CA-C-O 119.374 -0.681 . . . . 0.0 112.45 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.0 t -81.19 123.62 28.6 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 118.961 1.381 . . . . 0.0 107.552 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.48 -23.89 62.77 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.608 175.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 t -67.23 123.69 20.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -108.32 -23.78 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 C-N-CA 124.315 1.046 . . . . 0.0 110.06 178.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.422 ' HB2' HG22 ' A' ' 65' ' ' VAL . 10.5 p-90 -131.05 138.99 49.86 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.802 0.841 . . . . 0.0 110.502 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.469 HG11 ' HB1' ' A' ' 16' ' ' ALA . 62.0 t -136.34 149.96 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 175.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.465 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 23.3 p -104.34 159.76 15.45 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 176.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -124.45 123.82 40.97 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 175.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -98.45 175.78 5.91 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 176.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -127.03 124.05 38.45 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 106.781 -1.562 . . . . 0.0 106.781 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -112.69 123.42 50.27 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 104.261 -2.496 . . . . 0.0 104.261 175.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 23.04 -88.86 0.01 OUTLIER Glycine 0 CA--C 1.529 0.961 0 C-N-CA 127.661 2.553 . . . . 0.0 116.683 -176.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 65.0 p -92.66 2.22 56.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.059 2.143 . . . . 0.0 116.175 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -150.63 175.83 11.57 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.233 1.379 . . . . 0.0 114.647 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 11.6 mm -93.69 136.26 25.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 128.036 2.534 . . . . 0.0 106.256 175.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.8 m -135.31 159.36 72.09 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-O 118.475 -0.774 . . . . 0.0 110.561 176.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.12 155.46 47.24 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 121.753 1.635 . . . . 0.0 110.288 175.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -120.45 -152.86 9.0 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 126.668 2.08 . . . . 0.0 109.728 176.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.42 164.97 5.11 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.491 1.117 . . . . 0.0 110.736 176.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -145.03 162.29 37.31 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.252 1.421 . . . . 0.0 110.127 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.72 176.7 42.91 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-O 122.055 0.809 . . . . 0.0 112.512 -179.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -125.46 -6.07 7.04 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.049 1.739 . . . . 0.0 111.965 -176.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.23 141.9 43.99 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 -177.17 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -83.89 -14.52 50.87 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -174.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -60.56 -36.11 77.68 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 119.885 -1.76 . . . . 0.0 109.564 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -71.7 -22.76 61.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.323 1.049 . . . . 0.0 112.034 175.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -67.09 -43.57 82.2 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.339 1.056 . . . . 0.0 109.522 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.0 mm -54.32 -47.24 69.3 Favored 'Isoleucine or valine' 0 C--N 1.342 0.245 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -176.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.3 mm-40 -65.03 -23.93 67.34 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.53 0.732 . . . . 0.0 112.502 -176.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -77.39 -24.26 50.56 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 119.444 1.02 . . . . 0.0 111.359 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.2 m -73.83 113.62 11.19 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.07 -1.455 . . . . 0.0 107.07 177.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.31 2.1 p -100.73 178.39 4.72 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.892 1.277 . . . . 0.0 110.594 -176.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.09 -76.15 0.1 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 117.951 2.574 . . . . 0.0 117.951 -174.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.39 -27.8 19.09 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 120.226 1.375 . . . . 0.0 114.569 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.7 m -70.63 169.66 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 120.895 -1.128 . . . . 0.0 112.165 -175.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.441 ' HD3' ' H ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -121.3 144.77 48.45 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.805 1.242 . . . . 0.0 107.986 178.059 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.9 tp -146.79 166.63 26.06 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.058 1.743 . . . . 0.0 107.702 -176.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -133.08 157.82 44.31 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 176.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.71 153.51 41.06 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 118.744 0.702 . . . . 0.0 111.139 175.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.403 ' CE1' ' HB3' ' A' ' 79' ' ' PHE . 54.7 t80 -119.86 123.64 44.12 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 104.536 -2.394 . . . . 0.0 104.536 175.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.422 HG22 ' HB2' ' A' ' 29' ' ' TRP . 39.3 t -135.15 138.72 48.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 O-C-N 123.222 0.326 . . . . 0.0 110.209 -175.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.7 ttm180 -75.41 117.85 17.65 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.639 1.976 . . . . 0.0 106.949 175.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -131.88 150.92 52.01 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 84.7 m . . . . . 0 N--CA 1.453 -0.308 0 O-C-N 121.517 -0.74 . . . . 0.0 111.153 -175.668 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.2 m . . . . . 0 N--CA 1.447 -0.582 0 CA-C-O 121.466 0.65 . . . . 0.0 109.845 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.416 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 2.4 mptp? -55.78 143.35 31.34 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.379 0.671 . . . . 0.0 109.585 177.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -119.38 162.46 18.76 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 t -139.55 151.73 46.32 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.3 mttp -146.39 175.81 10.26 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.686 1.995 . . . . 0.0 107.076 176.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.403 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . 92.1 m-85 -140.26 134.69 31.4 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 175.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -104.83 114.26 28.36 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 124.877 1.361 . . . . 0.0 107.401 177.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -83.47 113.53 20.84 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 102.339 -3.208 . . . . 0.0 102.339 175.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 mt -96.75 142.66 13.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 -176.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.3 m -125.59 123.46 39.08 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 104.382 -2.451 . . . . 0.0 104.382 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 39.5 t-105 -103.06 124.28 48.24 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 104.825 -2.287 . . . . 0.0 104.825 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 mm -125.54 110.06 23.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 103.562 -2.755 . . . . 0.0 103.562 175.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.441 ' O ' HG12 ' A' ' 89' ' ' VAL . . . -54.96 126.8 39.54 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 107.643 -2.183 . . . . 0.0 107.643 175.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.53 -12.25 2.58 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 118.786 1.293 . . . . 0.0 112.833 -175.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -83.77 -30.68 26.43 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 117.324 -1.322 . . . . 0.0 111.401 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.441 HG12 ' O ' ' A' ' 86' ' ' GLY . 8.4 p -74.14 143.82 13.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 121.083 1.765 . . . . 0.0 111.392 -175.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.0 t -143.16 176.69 8.93 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.463 1.905 . . . . 0.0 106.938 175.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 79.58 -156.32 40.65 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 176.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.0 tt -59.27 -42.52 91.41 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.404 1.081 . . . . 0.0 112.535 -175.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -33.62 73.86 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 120.706 1.594 . . . . 0.0 111.536 -176.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.31 -50.33 27.83 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 175.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.34 -27.02 67.03 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 125.17 1.388 . . . . 0.0 113.41 -176.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -46.26 -41.32 12.85 Favored 'General case' 0 CA--C 1.502 -0.889 0 C-N-CA 124.489 1.116 . . . . 0.0 110.205 175.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.2 m -52.79 -39.6 62.47 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.422 1.089 . . . . 0.0 111.144 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -74.86 -10.31 83.59 Favored Glycine 0 CA--C 1.532 1.146 0 O-C-N 121.351 -0.843 . . . . 0.0 113.612 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 47.2 m -112.46 -15.14 13.15 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.358 1.863 . . . . 0.0 110.763 177.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -104.31 -29.33 10.85 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 126.504 1.921 . . . . 0.0 112.898 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -54.41 -33.04 58.59 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 119.901 1.228 . . . . 0.0 112.885 177.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.8 t -63.95 -34.19 77.43 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 118.842 0.746 . . . . 0.0 111.412 176.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.634 HD11 ' HB ' ' A' ' 6' ' ' THR . 30.8 mt -67.76 -61.82 1.7 Allowed 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 125.678 1.591 . . . . 0.0 109.478 -175.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -58.67 -33.33 48.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-O 118.147 -0.93 . . . . 0.0 109.173 175.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 63.0 tttt -64.92 -42.07 95.03 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 120.481 1.491 . . . . 0.0 110.232 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.78 -26.06 61.4 Favored 'General case' 0 C--N 1.335 -0.048 0 CA-C-N 119.146 0.885 . . . . 0.0 111.952 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 69.7 t -84.27 -61.74 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 175.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.05 26.53 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 129.843 3.257 . . . . 0.0 113.448 -175.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -50.54 -26.78 5.61 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 119.895 -1.753 . . . . 0.0 112.491 -176.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -88.75 74.49 8.33 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 175.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -140.04 161.0 38.66 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 175.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -87.49 -66.83 0.87 Allowed 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.201 -176.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.99 176.34 12.32 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 129.615 3.166 . . . . 0.0 108.698 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -119.89 165.73 14.24 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.345 1.058 . . . . 0.0 112.74 -175.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -133.94 147.31 51.05 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 104.311 -2.478 . . . . 0.0 104.311 -175.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.8 t -123.14 129.52 74.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 176.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -132.9 141.14 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 125.26 1.424 . . . . 0.0 107.752 -176.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 p -139.38 -2.26 1.63 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 175.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -129.07 151.35 49.85 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 124.512 1.125 . . . . 0.0 110.182 178.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 40.8 ttp-105 -58.19 -45.43 87.59 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 123.103 0.561 . . . . 0.0 110.881 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -65.66 -23.48 66.8 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.65 0.659 . . . . 0.0 110.539 -176.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -83.37 -23.25 32.53 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.9 2.08 . . . . 0.0 110.986 175.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -77.35 -23.29 50.9 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.692 1.597 . . . . 0.0 112.536 178.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 -63.4 123.78 19.59 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -175.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -49.69 -25.25 2.77 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 119.28 3.067 . . . . 0.0 119.28 175.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -63.33 -56.26 17.83 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 119.335 0.971 . . . . 0.0 113.154 -175.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -78.37 -26.09 46.52 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 118.0 -1.48 . . . . 0.0 109.152 -177.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 19.4 mt -52.7 -40.5 34.81 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 C-N-CA 124.899 1.28 . . . . 0.0 108.926 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 33.8 mttp -54.8 -49.49 70.84 Favored 'General case' 0 N--CA 1.457 -0.075 0 CA-C-N 118.213 0.46 . . . . 0.0 111.766 176.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 35.1 t -72.0 -36.31 69.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.059 0.544 . . . . 0.0 111.379 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.15 -46.03 91.05 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 119.466 1.03 . . . . 0.0 108.603 176.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 74.1 mt -66.6 -23.92 66.25 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 123.849 0.86 . . . . 0.0 110.883 175.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 16.1 mttt -73.0 -47.81 41.88 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 120.413 1.461 . . . . 0.0 107.182 175.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -61.44 -60.78 3.19 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.716 0.806 . . . . 0.0 109.036 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.527 0 C-N-CA 125.087 1.355 . . . . 0.0 112.124 175.824 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.307 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.9 m -142.99 158.27 43.76 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.608 1.563 . . . . 0.0 106.962 -175.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -132.66 -171.73 2.73 Favored 'General case' 0 CA--C 1.518 -0.282 0 O-C-N 121.273 -0.892 . . . . 0.0 111.92 -175.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.9 152.9 33.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 C-N-CA 124.388 1.075 . . . . 0.0 110.913 176.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -99.78 85.0 3.0 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 100.601 -3.851 . . . . 0.0 100.601 174.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -61.24 -24.3 66.27 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 117.166 -1.397 . . . . 0.0 112.54 -175.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -76.95 -54.18 6.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 120.786 1.63 . . . . 0.0 109.205 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.11 -36.33 83.23 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.768 -0.583 . . . . 0.0 111.043 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 79.5 m -75.56 -38.84 58.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 118.966 -0.54 . . . . 0.0 111.526 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.7 ttt-85 -60.06 -34.53 73.55 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-O 116.789 -1.577 . . . . 0.0 109.024 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.87 -56.6 18.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 120.596 1.544 . . . . 0.0 110.509 -177.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.656 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -61.42 -43.69 98.44 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 118.507 0.594 . . . . 0.0 111.751 179.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -55.24 -44.19 75.27 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -59.51 -41.95 91.11 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.327 1.451 . . . . 0.0 111.105 -176.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.37 -60.99 2.77 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 123.984 0.802 . . . . 0.0 109.88 175.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.498 ' CG2' HG23 ' A' ' 30' ' ' VAL . 71.0 t -59.06 -31.64 46.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 122.978 0.511 . . . . 0.0 111.58 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -37.25 86.92 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 125.872 1.669 . . . . 0.0 110.769 176.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -81.59 123.21 28.48 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 124.013 0.821 . . . . 0.0 109.68 -176.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.13 -17.87 64.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 118.596 -0.716 . . . . 0.0 112.884 175.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.28 -12.44 80.67 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.737 1.16 . . . . 0.0 113.061 176.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.1 t -80.06 137.9 36.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 119.559 1.68 . . . . 0.0 109.038 -177.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -74.34 -18.59 60.67 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.233 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.0 t -82.45 123.83 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 106.495 -1.668 . . . . 0.0 106.495 176.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -113.64 -23.65 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.66 -178.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 26.5 p-90 -129.48 135.49 48.7 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.636 0.774 . . . . 0.0 109.19 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.656 HG11 ' HB1' ' A' ' 16' ' ' ALA . 33.4 t -136.03 166.34 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 175.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 65.1 p -123.55 161.67 24.48 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.946 0.898 . . . . 0.0 109.757 175.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -128.18 123.7 34.98 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 175.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -95.21 176.16 6.33 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 178.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -122.53 140.35 52.87 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -142.12 143.46 33.03 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.728 1.611 . . . . 0.0 107.219 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 36.62 -104.69 0.03 OUTLIER Glycine 0 CA--C 1.528 0.857 0 C-N-CA 126.281 1.896 . . . . 0.0 113.55 -177.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.7 p -125.08 33.53 5.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.629 1.572 . . . . 0.0 111.224 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.2 t -142.78 175.85 9.51 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 122.022 0.915 . . . . 0.0 111.812 176.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.5 mm -102.92 137.96 29.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 126.035 1.734 . . . . 0.0 106.432 177.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.13 165.28 33.4 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 123.78 0.832 . . . . 0.0 109.583 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.78 168.33 24.86 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 121.842 1.695 . . . . 0.0 111.607 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.24 -170.74 12.08 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 126.495 1.998 . . . . 0.0 109.472 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -61.33 161.8 8.65 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.105 1.362 . . . . 0.0 111.215 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -145.13 174.11 11.34 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.06 1.344 . . . . 0.0 111.336 -178.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.39 -175.92 42.35 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 124.074 0.845 . . . . 0.0 111.568 177.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.96 -26.61 6.82 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 125.941 1.696 . . . . 0.0 110.134 175.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -108.15 130.47 55.12 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -82.96 -10.3 58.86 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -174.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 42.1 tt0 -54.09 -39.34 66.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 120.746 1.612 . . . . 0.0 111.156 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -56.93 -38.6 73.11 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.929 1.292 . . . . 0.0 111.769 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -59.0 -37.62 77.3 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.743 1.217 . . . . 0.0 108.525 -177.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.8 mm -61.96 -49.76 82.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -175.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -66.72 -32.42 73.71 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.52 0.6 . . . . 0.0 111.817 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -60.83 -38.89 87.01 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-O 118.786 -0.626 . . . . 0.0 111.192 -176.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.3 m -57.75 118.68 5.54 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.049 0.94 . . . . 0.0 110.442 -176.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.505 ' OG1' HG22 ' A' ' 59' ' ' VAL . 2.5 p -83.92 -173.9 4.98 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 129.28 3.032 . . . . 0.0 111.943 -176.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 19.9 p-10 -78.34 -70.29 0.5 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.112 0.965 . . . . 0.0 111.553 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -106.24 -36.34 6.9 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.378 1.871 . . . . 0.0 113.807 -175.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.505 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -60.41 129.86 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -175.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.82 141.95 35.23 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.289 1.835 . . . . 0.0 106.19 -175.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 tp -142.5 169.36 17.71 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.56 1.144 . . . . 0.0 110.892 -174.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.662 ' CZ ' HG23 ' A' ' 97' ' ' THR . 11.3 m-85 -124.43 143.57 50.55 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -128.0 147.72 50.51 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 125.723 1.609 . . . . 0.0 110.331 176.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -121.31 124.06 43.67 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 104.394 -2.447 . . . . 0.0 104.394 177.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.5 t -136.8 143.6 34.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 O-C-N 123.358 0.411 . . . . 0.0 110.804 -175.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.3 119.04 25.23 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.315 1.446 . . . . 0.0 107.517 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -136.39 126.93 26.92 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.451 1.1 . . . . 0.0 109.048 -176.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.5 m . . . . . 0 C--N 1.325 -0.472 0 C-N-CA 124.591 1.157 . . . . 0.0 110.169 -175.711 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.45 -0.465 0 CA-C-O 121.338 0.59 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -71.34 149.29 46.22 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 105.353 -2.092 . . . . 0.0 105.353 175.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -133.63 154.56 50.81 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 175.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.2 t -145.09 128.76 17.17 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -135.3 175.7 9.34 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -138.89 141.21 38.57 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.291 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -115.87 134.18 55.26 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 125.899 1.68 . . . . 0.0 107.438 -178.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -102.92 113.57 27.12 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 175.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mp -107.13 138.73 31.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 -175.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.3 m -121.32 123.47 42.24 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 104.766 -2.309 . . . . 0.0 104.766 -177.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -93.02 123.35 36.21 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 176.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.575 HD11 HG21 ' A' ' 97' ' ' THR . 5.9 mm -145.45 85.46 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 -177.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.655 ' O ' HG12 ' A' ' 89' ' ' VAL . . . -56.25 153.91 16.64 Favored Glycine 0 CA--C 1.532 1.136 0 O-C-N 121.551 -0.718 . . . . 0.0 112.205 -175.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -61.57 -19.44 62.17 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.565 -1.55 . . . . 0.0 112.132 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -83.36 -13.59 54.65 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 121.103 -0.998 . . . . 0.0 111.715 -176.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.655 HG12 ' O ' ' A' ' 86' ' ' GLY . 12.7 p -72.64 131.93 34.12 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-N 120.001 1.273 . . . . 0.0 110.007 179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.8 t -60.14 149.46 32.66 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.95 0.9 . . . . 0.0 109.367 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.53 -26.5 59.75 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.2 tt -68.89 -51.11 43.59 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 119.201 1.5 . . . . 0.0 110.668 177.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 19.9 mp0 -60.99 -38.82 87.35 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.315 -0.866 . . . . 0.0 109.5 175.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -61.62 -32.5 72.64 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.753 0.821 . . . . 0.0 111.248 175.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.79 -23.87 67.38 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.394 177.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.46 -54.05 50.24 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.913 1.688 . . . . 0.0 107.885 175.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.662 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 58.6 m -51.99 -38.22 55.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.864 0.866 . . . . 0.0 108.892 175.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -57.89 -19.87 38.67 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.067 1.318 . . . . 0.0 115.413 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 10.8 m -119.15 -2.94 10.64 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.816 1.808 . . . . 0.0 111.283 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -103.03 -23.7 13.67 Favored 'General case' 0 CA--C 1.516 -0.334 0 O-C-N 121.107 -0.995 . . . . 0.0 112.897 -175.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -49.77 -39.23 37.26 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.495 1.498 . . . . 0.0 112.604 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.8 t -59.87 -30.48 69.02 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.368 0.531 . . . . 0.0 111.753 -179.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.4 mt -64.47 -63.36 1.15 Allowed 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 124.562 1.145 . . . . 0.0 109.014 -178.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.436 HG12 ' H ' ' A' ' 104' ' ' VAL 0.251 0.9 OUTLIER -59.29 -29.38 41.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 118.603 -0.713 . . . . 0.0 109.655 175.83 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -63.32 -47.25 83.01 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 120.104 1.32 . . . . 0.0 109.017 175.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -52.42 -30.67 30.56 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.103 1.361 . . . . 0.0 111.92 -178.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 91.9 t -84.02 -54.41 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.054 0.942 . . . . 0.0 109.682 176.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 47.6 t -86.32 26.12 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 127.39 2.276 . . . . 0.0 114.081 -175.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -53.1 -26.55 16.78 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 119.749 -1.844 . . . . 0.0 114.752 -175.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -91.4 83.52 5.45 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -145.65 175.4 10.4 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 126.135 1.774 . . . . 0.0 107.759 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -101.95 -66.21 0.94 Allowed 'General case' 0 C--O 1.234 0.275 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -175.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -144.35 172.52 12.82 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 125.043 1.337 . . . . 0.0 109.598 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -126.59 168.37 14.4 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.159 0.984 . . . . 0.0 110.647 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -148.44 157.59 43.57 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 105.302 -2.11 . . . . 0.0 105.302 -175.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.4 t -131.8 124.19 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -123.92 141.53 43.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -179.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.3 p -129.26 3.2 5.17 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.517 1.127 . . . . 0.0 113.726 -176.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -137.73 124.56 21.2 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.693 1.197 . . . . 0.0 108.363 -175.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -64.56 -25.02 67.8 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.842 0.857 . . . . 0.0 112.189 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 32.6 mtmt -74.24 -47.32 35.98 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 119.973 1.261 . . . . 0.0 108.438 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -59.84 -39.17 84.22 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.622 -0.704 . . . . 0.0 111.662 178.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -44.04 -23.19 0.08 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 130.768 3.627 . . . . 0.0 115.554 -175.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -46.42 135.79 7.94 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 126.095 1.758 . . . . 0.0 109.68 175.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -63.87 -14.06 50.21 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 121.569 -0.707 . . . . 0.0 112.653 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -57.8 -55.32 36.44 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 119.168 0.895 . . . . 0.0 110.446 -176.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.33 -26.68 60.3 Favored 'General case' 0 C--N 1.351 0.657 0 C-N-CA 115.488 -2.485 . . . . 0.0 109.383 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 69.4 mt -60.41 -46.02 95.81 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -56.79 -52.69 64.05 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.31 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 34.1 t -61.85 -41.81 98.27 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.737 0.698 . . . . 0.0 110.335 -177.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -62.95 -51.31 67.38 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 123.668 0.787 . . . . 0.0 109.749 177.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 98.0 mt -63.7 -31.5 72.69 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.289 -1.507 . . . . 0.0 111.628 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -47.98 75.66 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.515 1.526 . . . . 0.0 107.953 175.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 46.9 mttm -62.02 -41.59 98.25 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.821 0.848 . . . . 0.0 109.234 175.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.219 0 C-N-CA 125.818 1.647 . . . . 0.0 112.98 -176.299 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.638 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.591 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.5 m -135.81 168.89 18.46 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 175.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -133.86 -178.31 4.96 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.556 -1.34 . . . . 0.0 112.662 -178.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.24 151.37 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 124.498 1.119 . . . . 0.0 108.933 178.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -93.61 77.41 4.34 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 101.881 -3.377 . . . . 0.0 101.881 174.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.77 -24.45 65.77 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.966 -1.016 . . . . 0.0 112.85 -175.161 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -70.24 -56.48 6.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 119.641 1.11 . . . . 0.0 109.128 -175.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.52 86.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.56 0.344 . . . . 0.0 110.488 176.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.1 m -64.99 -36.09 83.28 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.727 -0.608 . . . . 0.0 111.501 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -61.24 -35.0 76.04 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 117.461 -1.257 . . . . 0.0 110.092 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.55 -53.21 59.35 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 120.248 1.385 . . . . 0.0 110.541 -178.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.553 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -64.63 -41.02 96.44 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.752 0.706 . . . . 0.0 111.261 178.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -56.79 -39.08 73.46 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.268 1.027 . . . . 0.0 110.057 177.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -66.67 -46.32 76.05 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 126.141 1.776 . . . . 0.0 110.785 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.5 mp -58.62 -52.76 64.3 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 118.784 0.72 . . . . 0.0 112.001 175.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.487 ' CG2' HG23 ' A' ' 30' ' ' VAL . 31.5 t -63.52 -36.51 76.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 118.777 0.717 . . . . 0.0 110.603 -179.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.4 ttm-85 -63.7 -37.52 87.66 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 118.817 -0.611 . . . . 0.0 110.308 175.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -75.44 141.09 43.23 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.28 1.032 . . . . 0.0 113.189 -175.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -86.33 -11.85 50.99 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 126.448 1.899 . . . . 0.0 112.87 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -88.14 -35.8 8.67 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.0 t -54.39 138.45 39.69 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.892 1.677 . . . . 0.0 108.74 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.6 -35.52 60.52 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 175.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.8 t -63.08 127.22 22.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 C-N-CA 125.971 1.709 . . . . 0.0 109.99 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.5 pp -114.96 -23.83 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 126.489 1.916 . . . . 0.0 111.874 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 42.6 p-90 -126.27 148.86 49.42 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 119.577 1.08 . . . . 0.0 109.015 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.553 HG21 ' HB1' ' A' ' 16' ' ' ALA . 6.4 t -140.02 161.35 26.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 127.356 2.262 . . . . 0.0 106.682 176.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 17.2 p -124.07 156.73 36.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -132.5 124.7 29.02 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -110.32 176.47 5.04 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 -176.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.434 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 36.0 m-85 -123.28 136.5 54.72 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -176.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -148.76 124.03 10.21 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 175.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 54.95 -128.59 43.83 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 p -86.73 9.78 17.84 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.8 t -143.56 171.77 13.71 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 120.228 1.376 . . . . 0.0 114.604 -175.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.434 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 51.0 mm -90.76 137.13 22.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 101.826 -3.398 . . . . 0.0 101.826 174.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.1 m -121.83 158.95 53.17 Favored Pre-proline 0 C--O 1.236 0.376 0 C-N-CA 123.521 0.728 . . . . 0.0 110.132 176.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.19 154.61 61.82 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 121.167 1.245 . . . . 0.0 110.139 175.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.83 -171.31 15.0 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 127.295 2.379 . . . . 0.0 109.213 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -64.67 167.51 7.22 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 122.186 -0.597 . . . . 0.0 110.407 175.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -149.69 162.14 40.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.998 1.319 . . . . 0.0 109.02 -177.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.36 177.37 48.3 Favored Glycine 0 CA--C 1.524 0.615 0 CA-C-N 117.999 0.363 . . . . 0.0 112.227 -176.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.94 -7.23 17.1 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.222 1.409 . . . . 0.0 113.726 -175.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.6 137.93 45.71 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.737 1.215 . . . . 0.0 108.913 -175.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -84.54 -10.84 57.06 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 -175.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -61.45 -42.85 99.4 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 119.85 -1.781 . . . . 0.0 111.894 -176.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 75.4 m80 -68.96 -22.71 64.1 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.016 0.825 . . . . 0.0 111.393 178.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -61.83 -31.43 71.67 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 120.658 -1.277 . . . . 0.0 111.75 177.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.449 ' HA ' HD12 ' A' ' 123' ' ' LEU . 6.4 mm -62.03 -34.42 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -82.9 -32.64 27.21 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 117.834 -1.079 . . . . 0.0 110.099 175.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -53.82 -42.86 68.87 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 120.007 1.276 . . . . 0.0 111.081 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 76.5 m -60.89 113.42 2.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.415 ' OG1' HG22 ' A' ' 59' ' ' VAL . 2.3 p -83.62 176.93 8.65 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.466 1.506 . . . . 0.0 110.915 -176.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -72.19 -58.24 3.58 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 117.813 2.523 . . . . 0.0 117.813 -175.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -106.2 -35.51 7.17 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 117.181 2.289 . . . . 0.0 117.181 -174.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.415 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.7 m -67.77 173.37 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 123.007 1.384 . . . . 0.0 112.213 -175.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.8 ptt-85 -111.35 135.97 51.14 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 175.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.2 tp -134.48 162.15 33.05 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -131.99 147.23 52.44 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -139.38 126.97 21.75 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.37 0.668 . . . . 0.0 110.665 -178.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.415 ' CD1' HG13 ' A' ' 108' ' ' VAL . 37.6 t80 -95.65 123.36 39.17 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 101.933 -3.358 . . . . 0.0 101.933 175.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.2 t -135.09 136.17 51.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -175.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.2 ttm-85 -75.71 130.49 38.77 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.86 1.664 . . . . 0.0 106.853 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -136.28 157.92 45.66 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.251 1.02 . . . . 0.0 109.407 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.0 m . . . . . 0 CA--C 1.533 0.295 0 O-C-N 120.77 -1.206 . . . . 0.0 109.973 -176.116 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.446 -0.674 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.5 mmtt -71.13 164.93 24.64 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 175.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.3 mtp180 -131.59 168.62 17.38 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 -177.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.8 t -145.4 132.93 20.82 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.162 -1.422 . . . . 0.0 107.162 175.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp -123.48 176.08 6.39 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.761 2.024 . . . . 0.0 107.49 -177.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -141.89 143.73 33.46 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 176.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -119.91 133.32 55.61 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 177.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -97.71 113.12 24.81 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 175.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mp -99.38 144.0 12.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -125.32 123.6 39.77 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 104.737 -2.32 . . . . 0.0 104.737 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.1 t-105 -100.68 131.89 46.35 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 175.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.0 mt -136.27 108.92 8.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 175.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.97 134.65 22.33 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 175.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.81 -7.01 9.42 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.179 -1.189 . . . . 0.0 113.112 -175.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -83.65 -23.63 31.72 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 120.188 -1.57 . . . . 0.0 112.96 176.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 14.2 p -85.82 123.02 39.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 120.921 1.691 . . . . 0.0 110.974 -175.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 25.3 t -146.67 124.14 11.7 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 175.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.72 -167.17 27.2 Favored Glycine 0 C--O 1.24 0.494 0 N-CA-C 107.562 -2.215 . . . . 0.0 107.562 -175.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.0 tt -53.68 -39.36 65.07 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 117.915 0.857 . . . . 0.0 109.899 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -57.03 -36.22 70.21 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.389 0.995 . . . . 0.0 111.248 -176.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.25 -49.58 27.0 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.18 -24.04 51.7 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.525 1.13 . . . . 0.0 112.844 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -50.24 -45.01 53.68 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 124.764 1.225 . . . . 0.0 109.384 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.4 m -55.09 -39.13 68.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 118.891 0.769 . . . . 0.0 110.886 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.05 -26.12 74.14 Favored Glycine 0 CA--C 1.526 0.737 0 CA-C-N 119.164 0.893 . . . . 0.0 112.717 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 99.7 m -94.48 -17.92 21.97 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.995 1.718 . . . . 0.0 111.223 177.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -104.25 -23.56 13.22 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 126.201 1.8 . . . . 0.0 115.178 -174.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -52.46 -27.86 17.85 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 120.817 1.644 . . . . 0.0 113.902 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -62.64 -43.78 97.94 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.827 1.194 . . . . 0.0 109.404 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.591 HD11 ' HB ' ' A' ' 6' ' ' THR . 18.7 mt -55.2 -65.3 0.61 Allowed 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 125.774 1.63 . . . . 0.0 110.758 -175.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.406 HG12 ' H ' ' A' ' 104' ' ' VAL 0.288 0.8 OUTLIER -58.88 -28.67 38.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.564 176.196 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.8 tttm -69.24 -35.37 76.07 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 121.017 1.735 . . . . 0.0 110.312 175.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -57.71 -28.91 64.27 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 120.327 1.421 . . . . 0.0 110.366 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 89.3 t -79.97 -64.44 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 175.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.415 HG13 ' CD1' ' A' ' 64' ' ' PHE . 86.8 t -67.06 25.35 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 130.069 3.348 . . . . 0.0 114.431 -175.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -55.35 -26.6 41.92 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 118.884 -2.385 . . . . 0.0 115.217 -175.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -92.65 83.71 4.92 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 175.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -147.03 166.14 27.74 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.119 0.485 . . . . 0.0 109.702 175.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.72 -66.49 0.92 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.922 1.289 . . . . 0.0 110.04 -175.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -145.97 176.31 9.79 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 127.903 2.481 . . . . 0.0 109.592 175.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -117.14 167.48 11.15 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.693 1.197 . . . . 0.0 110.789 177.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -146.51 148.68 32.46 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -175.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 48.2 t -126.95 127.06 69.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 175.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mp -129.44 142.56 43.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 N-CA-C 106.348 -1.723 . . . . 0.0 106.348 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 p -130.08 -0.75 4.66 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.422 ' OD1' ' HE3' ' A' ' 121' ' ' LYS . 31.4 t0 -118.78 124.14 46.53 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.227 0.921 . . . . 0.0 109.267 176.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -65.63 -24.33 67.02 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.802 0.841 . . . . 0.0 111.189 -176.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.422 ' HE3' ' OD1' ' A' ' 119' ' ' ASP . 24.2 mtmt -76.45 -32.5 58.45 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.087 1.355 . . . . 0.0 110.017 175.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.61 -35.17 45.99 Favored 'General case' 0 C--O 1.215 -0.742 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.449 HD12 ' HA ' ' A' ' 52' ' ' ILE . 3.0 tm? -44.5 -23.14 0.1 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 131.173 3.789 . . . . 0.0 114.993 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -45.64 140.35 3.41 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.616 1.966 . . . . 0.0 110.374 175.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -64.76 -14.65 59.7 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.384 -0.823 . . . . 0.0 111.981 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -54.13 -52.41 61.16 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 118.228 -0.892 . . . . 0.0 112.793 -175.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -85.72 -26.23 26.0 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 117.034 -1.866 . . . . 0.0 109.0 -176.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 47.0 mt -58.64 -48.11 86.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -54.71 -54.54 40.47 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.513 -0.756 . . . . 0.0 110.467 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 29.8 t -60.67 -39.3 87.89 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.124 0.874 . . . . 0.0 110.299 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -68.96 -45.04 71.7 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.703 -0.623 . . . . 0.0 110.752 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.4 -33.56 76.16 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.319 1.048 . . . . 0.0 111.18 176.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -66.33 -51.51 56.54 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.444 1.498 . . . . 0.0 108.164 175.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -56.08 -45.07 79.48 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.237 0.926 . . . . 0.0 109.05 175.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.375 0 C-N-CA 124.876 1.27 . . . . 0.0 114.156 179.563 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.401 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.606 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.5 m -68.04 162.66 24.07 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 175.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -132.33 -179.35 5.38 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 120.964 -1.085 . . . . 0.0 109.282 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.47 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -139.82 150.53 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 124.795 1.238 . . . . 0.0 109.063 178.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -96.74 79.92 3.01 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 102.012 -3.329 . . . . 0.0 102.012 174.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -65.95 -24.24 66.77 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 117.819 -1.086 . . . . 0.0 112.953 -175.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -66.41 -56.11 12.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 176.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.83 -45.15 87.37 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 122.065 -0.397 . . . . 0.0 111.303 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.654 ' HB3' HG11 ' A' ' 107' ' ' VAL . 17.6 m -60.6 -40.37 91.55 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 118.484 -0.77 . . . . 0.0 111.224 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -62.21 -32.87 73.58 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.586 178.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.33 9.07 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 120.242 1.383 . . . . 0.0 110.014 176.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.452 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -54.45 -48.36 71.81 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.823 -0.548 . . . . 0.0 111.828 178.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -52.86 -48.59 66.96 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 124.004 0.922 . . . . 0.0 110.436 175.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.69 -43.83 98.1 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 117.1 -1.429 . . . . 0.0 110.677 -178.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.6 mp -58.01 -60.53 3.58 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 119.483 1.038 . . . . 0.0 109.534 175.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.467 ' CG2' HG23 ' A' ' 30' ' ' VAL . 43.9 t -59.74 -31.64 47.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 121.846 -0.534 . . . . 0.0 111.407 -176.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -73.33 -26.7 61.15 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.437 -0.79 . . . . 0.0 111.296 176.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -80.15 123.73 28.16 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.22 0.918 . . . . 0.0 110.025 -176.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.28 -23.0 67.15 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 123.66 0.784 . . . . 0.0 110.367 175.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.13 -3.87 88.67 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.075 1.798 . . . . 0.0 114.303 177.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.3 t -85.77 130.64 34.5 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.766 1.783 . . . . 0.0 109.608 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.6 -35.98 75.79 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 175.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 t -63.17 131.04 28.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -114.39 -23.6 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 126.034 1.733 . . . . 0.0 110.503 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.472 ' HB2' HG22 ' A' ' 65' ' ' VAL . 37.5 p-90 -131.09 141.77 50.2 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.296 1.039 . . . . 0.0 111.092 178.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.467 HG23 ' CG2' ' A' ' 20' ' ' VAL . 61.2 t -137.1 147.22 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 175.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.468 HG22 ' HB2' ' A' ' 63' ' ' ALA . 40.3 p -103.8 162.43 13.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.082 0.468 . . . . 0.0 109.83 178.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -134.32 141.82 47.05 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.768 1.627 . . . . 0.0 107.132 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -124.82 176.82 6.36 Favored 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 125.356 1.463 . . . . 0.0 107.569 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -113.9 145.05 42.04 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.456 0.646 . . . . 0.0 110.312 176.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -129.92 123.46 30.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 103.408 -2.812 . . . . 0.0 103.408 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 38.05 -94.28 0.01 OUTLIER Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.26 1.41 . . . . 0.0 113.883 -176.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.4 p -124.71 34.51 4.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.142 1.777 . . . . 0.0 112.994 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -144.71 172.86 12.41 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.321 1.048 . . . . 0.0 112.194 175.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.4 mm -98.4 132.35 43.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 C-N-CA 125.455 1.502 . . . . 0.0 107.028 176.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.5 m -120.65 160.52 43.94 Favored Pre-proline 0 C--O 1.235 0.327 0 C-N-CA 124.879 1.272 . . . . 0.0 110.251 175.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.02 160.88 44.85 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 120.971 1.114 . . . . 0.0 110.84 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -128.87 -173.11 13.33 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 106.837 -2.505 . . . . 0.0 106.837 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -69.8 171.59 8.98 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.822 -0.811 . . . . 0.0 111.212 177.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 -142.11 171.63 13.8 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.085 1.354 . . . . 0.0 111.749 -175.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.99 167.7 39.91 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-O 122.085 0.825 . . . . 0.0 112.695 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.93 -9.05 13.66 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 127.529 2.332 . . . . 0.0 112.474 -175.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.23 144.9 45.1 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 104.964 -2.235 . . . . 0.0 104.964 -177.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -84.06 -15.85 45.99 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -175.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -58.19 -37.22 74.35 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 120.916 1.689 . . . . 0.0 110.138 -178.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -73.38 -21.8 60.42 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.328 -0.857 . . . . 0.0 112.189 176.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -62.1 -46.47 88.91 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 120.423 1.465 . . . . 0.0 109.535 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.4 mp -61.39 -37.69 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -65.59 -39.04 91.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 122.668 0.387 . . . . 0.0 111.368 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -73.13 -24.02 60.55 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 126.543 1.937 . . . . 0.0 114.729 -175.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 85.1 m -63.67 118.12 7.8 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.289 2.3 p -82.72 163.2 21.47 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 122.662 1.22 . . . . 0.0 111.458 -175.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -46.6 -75.48 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 130.655 3.582 . . . . 0.0 115.949 -175.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -102.04 -36.63 8.51 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -175.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 18.5 m -62.12 166.98 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 -175.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -107.42 135.17 49.35 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 175.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.4 tp -132.29 170.82 14.51 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.179 1.792 . . . . 0.0 108.585 -175.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -136.33 157.03 47.77 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 124.537 1.135 . . . . 0.0 108.354 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.468 ' HB2' HG22 ' A' ' 31' ' ' THR . . . -152.67 129.71 11.09 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 119.17 0.895 . . . . 0.0 112.875 175.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -89.78 123.52 33.84 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 105.154 -2.165 . . . . 0.0 105.154 175.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.472 HG22 ' HB2' ' A' ' 29' ' ' TRP . 41.5 t -138.93 149.93 23.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 122.865 0.466 . . . . 0.0 110.61 -175.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -103.28 145.5 29.86 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.108 0.963 . . . . 0.0 110.325 175.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -136.5 149.9 48.4 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.131 1.373 . . . . 0.0 110.728 -176.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 CA--C 1.532 0.267 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 175.768 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.9 m . . . . . 0 N--CA 1.445 -0.696 0 N-CA-C 103.06 -2.941 . . . . 0.0 103.06 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -64.4 162.76 14.45 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -175.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 67.3 mtt180 -136.16 154.2 51.04 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 122.773 1.273 . . . . 0.0 110.732 -176.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 47.8 t -145.75 160.0 42.37 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 177.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -144.27 168.11 20.85 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 104.824 -2.287 . . . . 0.0 104.824 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -121.55 139.77 53.08 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 105.744 -1.947 . . . . 0.0 105.744 176.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -123.94 114.03 19.26 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 104.817 -2.29 . . . . 0.0 104.817 -176.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -89.09 113.29 24.42 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 102.892 -3.003 . . . . 0.0 102.892 175.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -88.59 140.35 15.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -125.96 123.18 37.95 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 102.232 -3.247 . . . . 0.0 102.232 175.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 48.2 t-105 -101.6 123.85 46.28 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 25.4 mt -142.2 78.39 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.09 149.96 11.0 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 108.792 -1.723 . . . . 0.0 108.792 175.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -68.19 -10.72 56.46 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.43 2.115 . . . . 0.0 113.001 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -83.6 -36.32 24.01 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 117.256 -1.354 . . . . 0.0 113.191 -175.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -53.21 133.92 15.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 CA-C-N 120.354 1.434 . . . . 0.0 110.049 175.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 31.4 t -58.72 156.48 10.96 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 123.209 1.481 . . . . 0.0 113.032 -175.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.64 -13.8 13.07 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 113.175 -1.83 . . . . 0.0 111.617 175.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.7 tp -72.01 -61.28 1.85 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 126.098 1.759 . . . . 0.0 110.621 175.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -68.55 -34.25 75.52 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.8 ttm180 -60.37 -42.66 96.27 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 175.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.27 -36.34 83.8 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-O 118.107 -0.949 . . . . 0.0 111.617 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -55.84 -38.38 69.99 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.945 1.248 . . . . 0.0 110.602 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 74.2 m -54.31 -34.52 61.16 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 119.739 1.154 . . . . 0.0 110.467 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.75 -25.73 70.65 Favored Glycine 0 CA--C 1.527 0.806 0 O-C-N 121.009 -1.057 . . . . 0.0 113.761 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.7 m -99.12 -13.41 19.81 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.589 1.956 . . . . 0.0 110.88 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -103.41 -24.11 13.5 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -174.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -59.73 -39.96 86.44 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 120.986 1.721 . . . . 0.0 111.149 -178.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.9 t -62.56 -31.22 71.98 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 118.611 -0.709 . . . . 0.0 110.732 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.606 HD11 ' HB ' ' A' ' 6' ' ' THR . 15.4 mt -62.81 -63.2 1.28 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 119.416 1.007 . . . . 0.0 109.573 -176.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.07 -30.36 47.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 117.188 -1.387 . . . . 0.0 109.455 175.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -61.91 -37.27 84.0 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 121.288 1.858 . . . . 0.0 110.288 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -60.79 -24.64 65.96 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 120.201 1.364 . . . . 0.0 111.117 179.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.654 HG11 ' HB3' ' A' ' 13' ' ' CYS . 43.7 t -86.82 -53.03 11.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 79.2 t -74.95 26.11 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 130.393 3.477 . . . . 0.0 111.427 -177.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -55.32 -26.13 38.74 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 119.618 -1.926 . . . . 0.0 112.492 -176.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -95.55 90.55 5.78 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 175.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -157.96 176.74 12.15 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.948 1.299 . . . . 0.0 108.041 179.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -106.31 -66.5 1.0 Allowed 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.829 -0.544 . . . . 0.0 112.013 177.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 14.0 mtpt -146.06 168.9 19.81 Favored 'General case' 0 CA--C 1.504 -0.826 0 C-N-CA 126.812 2.045 . . . . 0.0 110.017 176.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.33 179.72 4.19 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.82 -1.082 . . . . 0.0 109.553 175.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.25 140.63 23.25 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 104.256 -2.498 . . . . 0.0 104.256 -176.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.8 t -114.27 123.72 70.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -125.99 138.39 54.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 106.131 -1.803 . . . . 0.0 106.131 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.0 p -131.51 1.79 4.11 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -175.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -137.12 134.2 36.14 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.816 0.734 . . . . 0.0 109.455 177.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 17.3 ttp-105 -69.15 -28.83 66.78 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 118.195 -0.907 . . . . 0.0 112.723 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -70.42 -45.38 66.01 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 120.853 1.661 . . . . 0.0 106.623 175.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -58.37 -43.84 88.59 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 117.907 -1.044 . . . . 0.0 109.351 -176.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -44.04 -23.74 0.11 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 129.568 3.147 . . . . 0.0 115.081 -177.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -50.44 154.91 1.16 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 122.502 1.144 . . . . 0.0 114.064 175.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -61.08 -15.66 35.17 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 115.119 -0.946 . . . . 0.0 113.18 175.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -51.43 -64.95 0.65 Allowed 'General case' 0 C--O 1.242 0.689 0 CA-C-N 119.11 0.868 . . . . 0.0 111.022 176.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.92 -26.59 54.26 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 114.984 -2.686 . . . . 0.0 109.389 -175.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.7 -41.23 91.9 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 C-N-CA 123.7 0.8 . . . . 0.0 108.885 -176.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -62.1 -53.0 61.64 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 120.028 1.285 . . . . 0.0 109.929 179.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 44.0 t -65.08 -34.67 78.96 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 119.222 -0.418 . . . . 0.0 110.538 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -72.56 -44.38 62.16 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 123.902 0.881 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 65.0 mt -61.79 -31.05 71.23 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 118.342 -0.837 . . . . 0.0 108.853 175.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -69.43 -52.76 23.76 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.368 1.067 . . . . 0.0 109.298 174.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -51.34 -56.85 10.88 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.328 1.051 . . . . 0.0 109.531 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.691 0 C-N-CA 126.528 1.931 . . . . 0.0 113.794 177.816 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.517 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.4 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.4 m -119.05 170.89 8.66 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.63 1.972 . . . . 0.0 105.754 -177.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.0 tttt -139.04 176.28 8.83 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.612 -1.305 . . . . 0.0 111.247 -176.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.82 152.21 24.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 124.115 0.966 . . . . 0.0 108.961 175.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -100.34 78.6 2.05 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 104.678 -2.341 . . . . 0.0 104.678 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -61.89 -27.78 69.04 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.098 -0.953 . . . . 0.0 112.506 -175.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.22 -48.36 70.85 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 119.822 1.192 . . . . 0.0 110.255 177.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.16 -52.87 20.12 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.729 0.412 . . . . 0.0 110.121 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.9 m -62.31 -30.56 71.24 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.102 -0.951 . . . . 0.0 111.379 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.2 ttt180 -62.18 -35.19 78.1 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 115.946 -1.978 . . . . 0.0 109.112 175.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.87 -59.78 4.19 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 121.033 1.742 . . . . 0.0 109.906 -177.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.32 95.35 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.968 -0.458 . . . . 0.0 111.919 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -54.76 -46.31 74.34 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 175.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -58.07 -47.75 82.23 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.213 1.405 . . . . 0.0 110.102 -175.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -57.19 -62.92 1.42 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.014 0.926 . . . . 0.0 109.855 175.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.1 t -60.2 -24.95 32.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 O-C-N 121.559 -0.713 . . . . 0.0 112.244 -176.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -75.73 -31.33 59.57 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.45 1.1 . . . . 0.0 111.725 175.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.24 125.29 33.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 127.687 2.395 . . . . 0.0 112.665 -175.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.66 -19.47 58.4 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.232 1.013 . . . . 0.0 112.843 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.99 -10.09 86.42 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.015 1.293 . . . . 0.0 113.464 176.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.6 t -79.61 127.52 32.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 119.326 1.563 . . . . 0.0 109.053 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.36 -35.73 73.73 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 175.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.6 t -64.38 133.2 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 127.633 2.373 . . . . 0.0 108.571 175.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 pp -115.94 -23.66 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 126.109 1.763 . . . . 0.0 111.46 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 51.0 p-90 -123.57 147.87 46.88 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.838 0.855 . . . . 0.0 109.74 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.9 t -137.07 162.92 33.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 129.513 3.125 . . . . 0.0 107.835 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.444 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 41.3 p -125.18 159.15 32.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.61 1.164 . . . . 0.0 109.075 175.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -132.44 123.8 27.36 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -102.86 176.23 5.22 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 175.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.419 ' CE2' HD12 ' A' ' 39' ' ' ILE . 27.1 m-85 -128.53 129.41 45.98 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 -175.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -129.08 131.02 47.23 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.919 1.688 . . . . 0.0 106.487 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 45.53 -114.53 1.28 Allowed Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.114 -1.195 . . . . 0.0 110.114 -176.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 p -120.74 45.61 2.2 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.968 1.307 . . . . 0.0 111.208 176.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.5 t -142.93 169.42 17.6 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.419 HD12 ' CE2' ' A' ' 34' ' ' TYR . 7.7 mm -98.61 139.4 20.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 175.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.3 m -128.53 146.18 58.94 Favored Pre-proline 0 N--CA 1.469 0.491 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.289 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.14 150.22 59.44 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 121.988 1.792 . . . . 0.0 109.288 175.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -124.3 -157.57 9.8 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 125.784 1.659 . . . . 0.0 110.629 177.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -51.56 161.5 0.49 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 125.906 1.682 . . . . 0.0 112.277 176.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.4 164.95 33.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.57 1.148 . . . . 0.0 109.124 176.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.73 176.96 44.05 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 123.578 0.609 . . . . 0.0 111.751 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -107.79 -15.61 14.52 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.355 1.462 . . . . 0.0 113.533 -176.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -123.63 142.63 50.86 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 -176.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -83.36 -8.91 59.33 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.799 1.036 . . . . 0.0 113.799 -174.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -54.1 -36.85 63.64 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.846 1.203 . . . . 0.0 110.137 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -62.68 -28.81 70.19 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.044 1.337 . . . . 0.0 112.158 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . 0.424 ' CD1' HD11 ' A' ' 123' ' ' LEU . 0.7 OUTLIER -63.52 -52.45 61.16 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -178.966 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.52 -36.78 76.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -176.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -60.83 -31.88 71.29 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.67 0.788 . . . . 0.0 112.102 175.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -85.67 -24.04 27.19 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.008 0.923 . . . . 0.0 113.455 -175.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 96.6 m -59.85 120.75 10.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.602 1.092 . . . . 0.0 112.539 -175.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 2.4 p -104.92 -173.53 2.32 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 127.181 2.192 . . . . 0.0 113.898 -178.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -73.67 -75.93 0.14 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 129.619 3.168 . . . . 0.0 117.964 -175.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -102.35 -24.76 13.83 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.051 1.74 . . . . 0.0 115.353 -174.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.7 m -63.94 158.78 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 CA-C-O 122.816 1.293 . . . . 0.0 112.37 -175.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.3 ptt-85 -108.41 130.65 55.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 102.894 -3.002 . . . . 0.0 102.894 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 31.8 tp -140.7 156.09 46.3 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -175.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -131.38 148.72 52.69 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.444 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.94 129.16 16.69 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.344 0.658 . . . . 0.0 111.629 -179.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.424 ' CE1' HG13 ' A' ' 108' ' ' VAL . 33.0 t80 -96.44 123.64 40.16 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 175.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.3 t -134.39 141.4 43.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 123.426 0.69 . . . . 0.0 109.304 -175.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -85.06 137.84 32.8 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 175.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -131.49 168.22 18.01 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 127.648 2.379 . . . . 0.0 106.622 -176.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.3 m . . . . . 0 C--N 1.325 -0.496 0 O-C-N 121.069 -1.02 . . . . 0.0 108.739 -177.295 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.4 m . . . . . 0 N--CA 1.45 -0.441 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -46.16 152.84 0.37 Allowed 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.35 1.86 . . . . 0.0 113.254 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 -121.21 148.32 44.42 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 123.638 0.775 . . . . 0.0 109.881 -176.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.6 t -146.89 137.82 23.92 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.658 1.583 . . . . 0.0 109.168 175.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.442 ' HA ' ' HE2' ' A' ' 78' ' ' LYS . 4.4 mmpt? -145.99 176.04 10.0 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 127.998 2.519 . . . . 0.0 108.115 175.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -141.56 146.36 36.23 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 176.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -125.47 122.44 36.65 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 176.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -97.65 113.33 25.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 100.421 -3.918 . . . . 0.0 100.421 174.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.9 mp -97.36 144.71 10.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -123.62 123.36 40.4 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 103.258 -2.867 . . . . 0.0 103.258 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -96.04 123.48 39.66 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 103.716 -2.698 . . . . 0.0 103.716 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.652 HD11 HG21 ' A' ' 97' ' ' THR . 12.3 mt -144.91 97.77 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 104.134 -2.543 . . . . 0.0 104.134 178.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.62 166.02 4.75 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-O 121.717 0.621 . . . . 0.0 113.07 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -75.78 -19.23 59.15 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.213 -1.757 . . . . 0.0 110.009 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -82.72 -20.71 35.49 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 120.812 -1.18 . . . . 0.0 113.486 -175.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . 0.257 0.8 OUTLIER -66.33 140.16 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 119.852 1.205 . . . . 0.0 113.373 -177.777 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 47.7 t -70.88 144.59 50.62 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 126.136 1.774 . . . . 0.0 109.89 179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -60.51 -21.16 57.11 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-O 119.179 -0.79 . . . . 0.0 113.205 179.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 tt -65.06 -32.58 74.36 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.872 1.336 . . . . 0.0 110.062 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -80.09 -44.07 20.66 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 175.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.8 ttp85 -58.62 -25.03 62.24 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.514 1.052 . . . . 0.0 111.298 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.34 70.57 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 120.849 -1.157 . . . . 0.0 111.861 175.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -64.99 -39.12 92.99 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-O 118.032 -0.985 . . . . 0.0 108.764 175.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.652 HG21 HD11 ' A' ' 85' ' ' ILE . 2.5 m -54.26 -34.81 61.64 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.383 0.673 . . . . 0.0 110.137 179.132 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.67 -12.37 56.37 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 125.135 1.35 . . . . 0.0 114.805 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.6 m -125.45 2.7 7.68 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.784 2.034 . . . . 0.0 110.603 175.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -103.62 -42.93 5.51 Favored 'General case' 0 C--O 1.226 -0.157 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -177.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.564 ' HE2' ' HG3' ' A' ' 114' ' ' GLU . 9.3 mtpm? -59.59 -28.81 67.49 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.52 -1.363 . . . . 0.0 112.44 -176.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.5 t -68.14 -47.01 69.23 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.458 1.503 . . . . 0.0 108.855 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.4 HD11 ' HB ' ' A' ' 6' ' ' THR . 14.5 mt -59.44 -58.04 10.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.855 1.662 . . . . 0.0 109.987 -176.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.4 p -62.21 -30.93 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-O 117.27 -1.347 . . . . 0.0 109.667 176.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.82 -31.16 72.24 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 121.178 1.808 . . . . 0.0 110.893 176.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -63.57 -25.73 68.37 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 120.154 1.343 . . . . 0.0 111.099 176.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 57.5 t -86.19 -56.97 4.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 175.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.424 HG13 ' CE1' ' A' ' 64' ' ' PHE . 86.3 t -73.01 26.65 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 131.106 3.762 . . . . 0.0 112.127 -175.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -52.76 -21.63 4.34 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 119.679 -1.888 . . . . 0.0 113.717 -176.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -99.02 84.39 3.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 174.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -147.42 170.11 18.07 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 175.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 -66.32 0.91 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -176.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -152.85 169.26 23.25 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 127.12 2.168 . . . . 0.0 108.159 175.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.564 ' HG3' ' HE2' ' A' ' 101' ' ' LYS . 0.7 OUTLIER -107.19 167.77 9.68 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 175.193 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -137.6 152.17 49.11 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 -175.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.8 t -121.24 124.87 72.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 175.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mp -124.94 141.47 44.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 176.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.2 p -130.89 6.46 4.65 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.304 1.442 . . . . 0.0 112.827 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -139.81 128.87 23.65 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.573 0.624 . . . . 0.0 111.305 175.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 -64.99 -32.87 74.8 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 124.778 1.231 . . . . 0.0 113.966 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.696 ' H ' ' HE3' ' A' ' 121' ' ' LYS . 0.3 OUTLIER -76.21 -41.04 50.69 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 120.98 1.718 . . . . 0.0 109.667 176.622 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.9 -37.42 86.88 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.022 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.424 HD11 ' CD1' ' A' ' 51' ' ' PHE . 2.4 tm? -45.0 -23.65 0.16 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 129.382 3.073 . . . . 0.0 115.076 -176.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -44.41 140.19 2.4 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.74 1.216 . . . . 0.0 110.856 175.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.29 -14.56 2.94 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -54.01 -55.6 25.78 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 124.345 1.058 . . . . 0.0 111.97 177.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.42 -25.7 35.96 Favored 'General case' 0 C--N 1.352 0.682 0 C-N-CA 116.614 -2.035 . . . . 0.0 108.713 -177.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 64.8 mt -60.74 -49.04 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -55.61 -51.33 67.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.266 0.626 . . . . 0.0 109.878 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.0 t -63.88 -38.55 91.5 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.454 0.702 . . . . 0.0 111.007 -176.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -67.91 -40.29 83.46 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.838 1.255 . . . . 0.0 109.688 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 96.7 mt -72.82 -24.69 60.94 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.07 -1.018 . . . . 0.0 110.339 175.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.6 mtpt -73.78 -47.29 39.97 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 125.185 1.394 . . . . 0.0 108.403 175.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -54.01 -65.41 0.57 Allowed 'General case' 0 C--O 1.234 0.251 0 C-N-CA 126.247 1.819 . . . . 0.0 108.508 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 176.299 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.326 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 m -71.01 149.29 46.77 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.163 2.185 . . . . 0.0 106.283 175.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.6 mtmt -132.02 179.97 5.77 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.091 0.956 . . . . 0.0 109.413 -176.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.581 HG22 HG12 ' A' ' 39' ' ' ILE . 0.2 OUTLIER -121.25 153.67 24.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 C-N-CA 124.129 0.971 . . . . 0.0 110.189 176.188 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -91.57 80.57 5.39 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 103.682 -2.71 . . . . 0.0 103.682 175.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -62.88 -27.4 69.33 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 117.383 -1.294 . . . . 0.0 111.94 -175.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -72.33 -53.9 11.05 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 119.64 1.109 . . . . 0.0 109.236 178.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.39 -43.82 96.47 Favored 'General case' 0 CA--C 1.527 0.069 0 CA-C-N 118.342 0.519 . . . . 0.0 111.064 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 81.2 m -70.27 -30.6 67.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.373 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -61.15 -34.54 75.18 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-O 116.834 -1.555 . . . . 0.0 109.853 176.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.28 -57.73 10.08 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 119.753 1.161 . . . . 0.0 110.157 -177.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.49 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -66.86 -41.94 86.5 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.208 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -52.7 -40.13 62.67 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 123.312 0.645 . . . . 0.0 111.104 175.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -63.21 -45.06 93.46 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.81 0.844 . . . . 0.0 110.574 -176.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.53 -50.68 72.57 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 123.853 0.861 . . . . 0.0 110.605 175.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.6 t -65.99 -30.52 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-O 119.49 -0.29 . . . . 0.0 111.218 -178.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.455 ' CZ ' ' HA ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -66.5 -48.84 68.54 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 118.077 -0.964 . . . . 0.0 108.725 175.764 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.455 ' HA ' ' CZ ' ' A' ' 21' ' ' ARG . 7.5 t70 -62.16 140.53 58.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 123.981 0.801 . . . . 0.0 112.289 -175.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -78.75 -19.51 52.13 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 117.566 -1.207 . . . . 0.0 113.691 -175.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -105.99 -1.66 39.14 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 118.846 -0.975 . . . . 0.0 114.096 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 t -71.74 147.95 46.85 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.365 1.582 . . . . 0.0 109.133 176.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.88 -33.11 59.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.328 176.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.7 t -74.79 123.48 30.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 175.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.2 pp -114.64 -23.89 4.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 C-N-CA 124.289 1.035 . . . . 0.0 110.874 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.405 ' CZ2' ' HA3' ' A' ' 45' ' ' GLY . 34.3 p-90 -124.64 144.98 49.89 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.632 0.773 . . . . 0.0 109.194 178.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.49 HG21 ' HB1' ' A' ' 16' ' ' ALA . 5.8 t -135.68 161.93 37.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 127.113 2.165 . . . . 0.0 107.594 176.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 72.3 p -125.55 157.83 36.1 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 175.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -127.5 123.71 36.57 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 176.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -94.46 176.01 6.46 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.44 ' CE2' HD12 ' A' ' 39' ' ' ILE . 21.7 m-85 -119.65 137.5 53.84 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 175.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -137.47 123.97 20.86 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 50.67 -110.88 1.03 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.5 p -110.71 27.39 9.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.648 1.579 . . . . 0.0 112.56 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -148.07 172.6 14.01 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 119.25 0.932 . . . . 0.0 113.143 176.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.581 HG12 HG22 ' A' ' 8' ' ' ILE . 7.8 mm -99.0 134.19 38.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 105.063 -2.199 . . . . 0.0 105.063 175.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.1 m -127.66 159.62 65.08 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 123.186 0.594 . . . . 0.0 111.262 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.99 144.19 57.27 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 121.809 1.673 . . . . 0.0 110.428 175.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -113.83 -155.05 11.4 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 125.827 1.679 . . . . 0.0 110.078 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -63.56 159.61 18.38 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.688 1.195 . . . . 0.0 110.808 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -143.96 165.97 26.27 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 125.523 1.529 . . . . 0.0 109.043 176.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.405 ' HA3' ' CZ2' ' A' ' 29' ' ' TRP . . . -178.51 -175.65 45.78 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 124.016 0.817 . . . . 0.0 111.818 -176.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -118.39 -22.7 7.51 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.215 1.406 . . . . 0.0 112.465 -176.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -115.07 130.5 56.95 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 -176.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -83.04 -7.57 59.64 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.042 0.837 . . . . 0.0 111.456 -175.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -54.23 -37.16 64.3 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.283 -1.511 . . . . 0.0 111.69 175.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -70.11 -26.86 64.16 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.829 1.252 . . . . 0.0 112.444 177.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -62.49 -46.61 87.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.472 1.509 . . . . 0.0 109.477 -177.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 mp -61.12 -42.07 91.8 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -177.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -65.57 -24.01 66.98 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.369 0.531 . . . . 0.0 112.425 176.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -80.93 -23.9 38.56 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.842 1.201 . . . . 0.0 112.251 176.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 99.1 m -60.16 123.56 17.54 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 104.284 -2.488 . . . . 0.0 104.284 175.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.509 ' OG1' HG22 ' A' ' 59' ' ' VAL . 72.7 p -82.84 174.04 11.3 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -174.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -60.76 -76.55 0.05 OUTLIER 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.433 2.293 . . . . 0.0 109.424 176.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -106.4 -36.53 6.79 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -175.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.509 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -60.62 165.7 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.293 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -174.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 28.1 ptt-85 -103.77 151.62 22.83 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 175.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.8 tp -148.65 161.53 41.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -127.16 151.07 49.16 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.481 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.58 157.87 43.92 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.088 0.555 . . . . 0.0 111.842 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.419 ' CE1' HG13 ' A' ' 108' ' ' VAL . 34.0 t80 -131.37 123.78 28.95 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 -178.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 39.6 t -137.67 141.63 38.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -175.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.2 ttp-105 -83.99 138.31 33.18 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 175.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -136.13 153.58 51.25 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 125.474 1.509 . . . . 0.0 107.837 -177.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 92.3 m . . . . . 0 N--CA 1.446 -0.631 0 O-C-N 121.124 -0.985 . . . . 0.0 109.122 -179.152 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 66.5 m . . . . . 0 N--CA 1.445 -0.691 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -61.32 155.4 21.36 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.583 0.706 . . . . 0.0 109.847 -177.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 46.6 mtp180 -133.55 176.32 8.65 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 126.044 1.738 . . . . 0.0 109.351 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 8.5 t -142.35 160.17 40.79 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 124.473 1.109 . . . . 0.0 110.109 -176.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -145.06 171.57 14.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 130.852 3.661 . . . . 0.0 106.608 176.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -143.18 143.44 31.78 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 175.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.57 118.3 31.77 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 178.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -87.88 113.7 23.79 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 101.988 -3.338 . . . . 0.0 101.988 175.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.6 mp -101.31 143.14 14.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 -176.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -125.69 123.58 39.23 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 175.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -93.37 123.72 36.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 104.868 -2.271 . . . . 0.0 104.868 175.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.8 mt -143.12 92.29 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -58.93 156.11 24.84 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 108.308 -1.917 . . . . 0.0 108.308 175.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -74.33 -4.43 36.25 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 119.997 -1.884 . . . . 0.0 111.084 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -83.83 -36.4 23.52 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 121.254 -0.904 . . . . 0.0 110.771 -175.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.5 p -64.45 128.99 27.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 175.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.4 t -60.5 154.33 21.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.527 1.156 . . . . 0.0 111.745 -175.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -53.67 -30.84 44.19 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 125.59 1.567 . . . . 0.0 113.179 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.6 tt -62.97 -41.44 99.55 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.489 1.116 . . . . 0.0 111.12 178.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -76.92 -41.24 44.29 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.45 -35.0 62.53 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.64 1.109 . . . . 0.0 109.806 175.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.37 -30.25 64.72 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 119.877 1.217 . . . . 0.0 113.412 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 23.7 mmtp -57.88 -31.91 67.17 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 119.384 0.993 . . . . 0.0 110.833 175.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.5 m -56.65 -33.98 66.87 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.493 1.042 . . . . 0.0 109.933 -178.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.23 -14.97 67.14 Favored Glycine 0 CA--C 1.535 1.324 0 CA-C-O 119.143 -0.81 . . . . 0.0 113.834 177.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.8 m -112.32 -4.62 14.27 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.684 2.394 . . . . 0.0 110.245 176.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -104.48 -35.36 7.92 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 124.257 1.023 . . . . 0.0 111.532 -175.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -59.6 -34.71 73.09 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.108 -0.995 . . . . 0.0 111.058 -177.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 7.0 t -66.98 -33.87 76.52 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.804 1.241 . . . . 0.0 110.369 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.538 ' O ' HG21 ' A' ' 8' ' ' ILE . 13.2 mt -70.91 -63.29 1.13 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.687 1.195 . . . . 0.0 108.88 -176.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.267 0.9 OUTLIER -59.46 -25.2 30.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-O 117.909 -1.043 . . . . 0.0 109.537 175.562 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -61.8 -41.97 98.42 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 120.909 1.686 . . . . 0.0 108.818 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -51.03 -31.03 17.08 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 120.704 1.593 . . . . 0.0 111.75 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 96.4 t -85.32 -63.57 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 124.685 1.194 . . . . 0.0 108.096 175.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.419 HG13 ' CE1' ' A' ' 64' ' ' PHE . 45.0 t -71.14 26.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 C-N-CA 130.566 3.546 . . . . 0.0 112.824 -175.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -57.63 -26.96 62.35 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.776 -1.828 . . . . 0.0 113.525 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -91.56 79.87 5.45 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 175.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -144.0 165.05 28.84 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 123.225 0.61 . . . . 0.0 109.569 177.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.63 -66.63 0.89 Allowed 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.36 175.72 12.8 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 126.451 1.901 . . . . 0.0 109.176 -175.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -115.41 164.51 14.17 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 123.429 0.456 . . . . 0.0 110.67 175.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -139.95 142.22 36.39 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 102.659 -3.089 . . . . 0.0 102.659 -175.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.34 128.5 73.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 176.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -128.25 145.14 35.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 125.985 1.714 . . . . 0.0 106.796 -176.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 42.0 p -131.31 -7.07 3.79 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.558 1.143 . . . . 0.0 113.464 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -116.73 130.08 56.51 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 15.2 ttp-105 -72.88 -28.54 62.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 118.61 -0.71 . . . . 0.0 111.964 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -69.89 -45.79 66.88 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 119.503 1.047 . . . . 0.0 109.017 175.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -53.55 -47.36 70.09 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 124.434 1.094 . . . . 0.0 110.16 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -43.91 -24.11 0.12 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 128.483 2.713 . . . . 0.0 116.793 -175.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -44.6 143.38 1.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 124.097 0.959 . . . . 0.0 110.636 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -60.33 -21.19 61.75 Favored 'General case' 0 C--N 1.341 0.213 0 O-C-N 121.587 -0.695 . . . . 0.0 111.024 -178.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -46.1 -59.17 3.03 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 125.34 1.456 . . . . 0.0 112.308 -175.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -81.15 -26.33 36.17 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 115.933 -2.307 . . . . 0.0 109.274 -176.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 36.2 mt -57.83 -44.07 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -60.34 -50.22 74.49 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 123.54 0.736 . . . . 0.0 111.64 -175.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -75.7 -30.68 59.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.554 0.616 . . . . 0.0 111.368 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.09 -46.46 81.02 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.044 -1.035 . . . . 0.0 108.922 176.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.64 -26.16 67.69 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.084 0.954 . . . . 0.0 111.648 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -63.59 -60.54 3.2 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 175.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? -53.82 -57.36 11.19 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 123.652 0.595 . . . . 0.0 110.474 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.369 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -176.281 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.379 0 N-CA-C 110.361 -1.095 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.0 pt -131.19 98.02 3.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 125.669 1.588 . . . . 0.0 107.009 178.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 69.6 mtp85 -103.57 148.67 25.71 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.5 tpt -71.33 82.11 0.76 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 175.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -144.19 44.52 1.44 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 127.243 2.217 . . . . 0.0 108.105 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.6 m -83.72 172.64 12.05 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.417 2.287 . . . . 0.0 107.538 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.503 ' HG3' ' H ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -150.14 -177.12 5.74 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 119.908 -1.745 . . . . 0.0 111.298 -175.407 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.503 ' H ' ' HG3' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -142.8 146.75 21.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 C-N-CA 127.312 2.245 . . . . 0.0 105.384 175.073 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -92.07 83.42 5.13 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 102.167 -3.271 . . . . 0.0 102.167 174.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.9 pttt -58.22 -33.48 69.37 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-O 117.167 -1.397 . . . . 0.0 113.064 -175.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -78.03 -44.26 27.0 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 120.354 1.434 . . . . 0.0 110.353 -176.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.8 -40.06 94.61 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 119.249 0.932 . . . . 0.0 110.537 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 62.0 m -72.45 -34.8 68.01 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.45 -0.781 . . . . 0.0 110.625 178.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.98 -35.97 74.1 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.904 175.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.14 -54.15 49.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 119.071 0.851 . . . . 0.0 109.997 -176.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.41 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -67.46 -40.96 85.35 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.665 0.666 . . . . 0.0 111.297 177.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -50.62 -47.89 58.18 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.264 0.626 . . . . 0.0 110.781 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -54.66 -41.04 69.67 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.899 1.28 . . . . 0.0 111.636 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 mp -68.81 -61.52 1.77 Allowed 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 124.183 0.993 . . . . 0.0 110.697 175.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.3 t -55.83 -31.55 30.19 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.317 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.783 -175.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -29.98 67.83 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.617 1.099 . . . . 0.0 111.916 175.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -85.6 125.84 33.44 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.665 1.121 . . . . 0.0 112.546 -175.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -61.79 -15.8 44.5 Favored 'General case' 0 C--N 1.344 0.346 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 175.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -95.91 -9.37 57.35 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 125.286 1.422 . . . . 0.0 112.61 176.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.0 t -66.8 127.08 31.11 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 120.338 2.069 . . . . 0.0 108.162 175.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.8 -32.73 73.97 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.7 t -72.57 123.69 27.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 104.424 -2.436 . . . . 0.0 104.424 175.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -113.29 -25.27 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 C-N-CA 123.33 0.652 . . . . 0.0 109.974 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 24.7 p-90 -126.03 145.87 50.13 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 121.838 0.828 . . . . 0.0 109.418 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.41 HG21 ' HB1' ' A' ' 16' ' ' ALA . 6.0 t -138.33 159.97 31.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 127.664 2.386 . . . . 0.0 106.024 175.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 35.4 p -120.2 153.54 36.12 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 175.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -122.3 123.7 42.03 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 104.805 -2.295 . . . . 0.0 104.805 175.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 41.6 mmtt -102.37 176.46 5.17 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.538 1.935 . . . . 0.0 105.999 -177.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -126.44 152.32 46.56 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 175.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -146.63 163.92 34.3 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 125.888 1.675 . . . . 0.0 107.564 175.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 24.36 -88.18 0.01 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 128.51 2.957 . . . . 0.0 115.311 178.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 27.0 p -136.12 26.74 3.23 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.726 1.211 . . . . 0.0 110.154 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -142.53 157.24 44.94 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -175.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 1.8 mp -84.99 142.95 12.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 N-CA-C 103.935 -2.617 . . . . 0.0 103.935 175.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.46 161.72 57.34 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 125.398 1.479 . . . . 0.0 110.206 -177.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -71.41 152.89 61.02 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 121.572 1.515 . . . . 0.0 110.169 175.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -120.86 -152.37 8.82 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 126.103 1.811 . . . . 0.0 109.767 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.19 163.11 10.74 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.243 1.417 . . . . 0.0 110.458 175.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -141.77 161.19 38.56 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 126.455 1.902 . . . . 0.0 109.429 177.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -176.09 -179.66 46.68 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-O 121.981 0.767 . . . . 0.0 112.623 177.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.6 -13.93 9.13 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.433 1.493 . . . . 0.0 112.534 -176.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -120.73 130.98 54.28 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.524 1.13 . . . . 0.0 107.958 -175.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -83.48 -13.08 55.45 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -175.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -57.81 -43.48 85.75 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 119.776 -1.827 . . . . 0.0 109.635 175.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -68.85 -21.93 64.25 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 119.048 -0.501 . . . . 0.0 111.585 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -61.45 -43.86 98.12 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 120.373 1.442 . . . . 0.0 107.9 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.3 mm -56.71 -47.27 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 123.475 0.71 . . . . 0.0 109.268 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -61.2 -40.25 93.27 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.527 0.731 . . . . 0.0 111.315 -177.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -69.87 -23.33 63.24 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 125.528 1.531 . . . . 0.0 113.894 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.5 m -65.23 113.55 4.08 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 176.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.301 2.1 p -91.07 -174.43 3.98 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.039 2.135 . . . . 0.0 111.746 -176.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -81.26 -75.95 0.26 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -175.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -95.19 -25.41 16.4 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 115.012 1.486 . . . . 0.0 115.012 -175.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 8.4 m -63.72 149.2 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 O-C-N 120.706 -1.246 . . . . 0.0 108.569 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 -103.28 129.44 50.28 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 103.174 -2.899 . . . . 0.0 103.174 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.3 tp -130.0 160.59 33.19 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -130.82 153.34 49.19 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 175.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.473 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -138.8 158.73 43.68 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.466 0.65 . . . . 0.0 110.338 175.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -129.64 123.48 31.33 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 103.88 -2.637 . . . . 0.0 103.88 177.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.3 t -134.53 135.34 53.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -175.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 59.5 ttp85 -80.64 123.63 28.31 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 104.883 -2.266 . . . . 0.0 104.883 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -135.26 123.83 23.57 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.278 1.037 . . . . 0.0 110.248 -175.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 26.8 m -86.41 114.09 22.9 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 124.364 1.066 . . . . 0.0 111.589 -175.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.3 m -156.49 166.63 32.86 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 175.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 101.91 113.79 3.75 Favored Glycine 0 CA--C 1.501 -0.797 0 N-CA-C 103.765 -3.734 . . . . 0.0 103.765 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -99.45 113.63 26.1 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 111.935 -2.133 . . . . 0.0 108.374 -174.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.96 178.28 8.65 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 125.41 1.484 . . . . 0.0 108.008 175.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.6 mmt -71.63 9.0 0.94 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.789 0.836 . . . . 0.0 110.621 175.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.5 m -146.34 151.51 37.61 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 118.928 -2.358 . . . . 0.0 107.387 175.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -63.21 157.81 21.64 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.327 0.585 . . . . 0.0 110.706 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 80.1 mtt-85 -141.86 155.54 45.54 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 105.05 -2.204 . . . . 0.0 105.05 175.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 t -144.25 160.85 40.29 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.4 mtpt -145.81 176.47 9.64 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 126.395 1.878 . . . . 0.0 108.795 -175.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -135.68 140.4 44.44 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -121.19 117.82 28.09 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.965 1.706 . . . . 0.0 107.222 -176.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -87.97 113.58 23.76 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 105.091 -2.188 . . . . 0.0 105.091 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.7 mt -104.4 143.2 16.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 -176.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -123.94 123.71 41.01 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 175.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -96.49 123.75 40.26 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 125.766 1.626 . . . . 0.0 106.731 175.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.4 mt -143.4 97.38 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 176.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -60.64 169.73 8.26 Favored Glycine 0 CA--C 1.537 1.431 0 CA-C-N 119.816 1.189 . . . . 0.0 112.101 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -76.96 -12.39 59.94 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 119.991 -1.888 . . . . 0.0 109.978 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -83.15 -29.69 28.45 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 120.207 -1.558 . . . . 0.0 112.511 -174.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.7 125.35 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 CA-C-O 121.586 0.708 . . . . 0.0 111.831 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 18.9 t -64.85 150.27 47.97 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 124.529 1.131 . . . . 0.0 110.681 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.45 -28.01 58.94 Favored Glycine 0 CA--C 1.521 0.448 0 C-N-CA 125.339 1.447 . . . . 0.0 113.913 -178.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.6 tt -59.2 -37.35 77.24 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.116 1.458 . . . . 0.0 110.241 176.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -73.76 -43.82 57.91 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 121.266 -0.896 . . . . 0.0 109.073 175.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -57.27 -28.93 63.42 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.847 -0.597 . . . . 0.0 110.359 177.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.74 -44.38 97.01 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 119.599 1.091 . . . . 0.0 109.703 176.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -59.07 -54.98 40.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 118.014 -0.994 . . . . 0.0 108.331 175.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 59.7 m -50.58 -39.63 50.18 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.925 0.89 . . . . 0.0 110.112 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.04 -26.4 74.03 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 118.562 -1.132 . . . . 0.0 113.745 -178.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.1 m -105.07 -0.41 26.72 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.627 1.571 . . . . 0.0 110.981 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -103.96 -24.16 13.27 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 124.809 1.244 . . . . 0.0 110.084 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -52.57 -37.96 58.99 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 119.883 1.22 . . . . 0.0 111.5 175.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.1 t -56.82 -41.68 78.25 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.067 0.849 . . . . 0.0 110.393 175.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 28.4 mt -64.18 -64.74 0.8 Allowed 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 125.871 1.668 . . . . 0.0 109.685 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -57.51 -30.76 37.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 117.852 -1.071 . . . . 0.0 110.257 175.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -65.42 -31.35 72.41 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 120.739 1.609 . . . . 0.0 110.468 176.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -63.52 -23.8 67.55 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 121.112 1.778 . . . . 0.0 111.966 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 81.1 t -85.55 -53.82 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 175.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 53.7 t -78.28 25.9 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 128.012 2.525 . . . . 0.0 111.993 -175.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -58.07 -25.65 61.53 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 120.031 -1.668 . . . . 0.0 109.864 175.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.01 67.8 4.8 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.298 1.839 . . . . 0.0 106.688 175.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.12 174.53 11.23 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 121.157 -0.964 . . . . 0.0 111.778 179.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -110.27 -47.63 3.27 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.761 0.825 . . . . 0.0 110.868 -176.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.2 mptt -158.7 174.68 14.67 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 128.414 2.686 . . . . 0.0 107.486 175.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -120.19 163.19 18.11 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.081 1.752 . . . . 0.0 109.661 176.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -140.54 156.64 46.25 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 103.744 -2.688 . . . . 0.0 103.744 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.8 t -132.58 127.97 57.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.5 mp -134.07 145.86 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 125.958 1.703 . . . . 0.0 109.21 -175.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 78.3 p -138.9 -5.9 1.48 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 126.664 1.985 . . . . 0.0 114.032 -175.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -141.54 153.94 45.17 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 119.227 0.921 . . . . 0.0 109.542 -176.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -37.94 89.22 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.954 -1.092 . . . . 0.0 111.523 -178.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 8.0 mttp -66.05 -31.14 71.85 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 124.745 1.218 . . . . 0.0 110.315 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -77.37 -23.39 50.81 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.448 1.899 . . . . 0.0 110.208 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -82.9 -23.13 33.69 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 127.025 2.13 . . . . 0.0 112.658 -178.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -57.9 123.47 15.92 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.183 0.901 . . . . 0.0 111.728 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.8 -23.98 55.09 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 115.639 1.718 . . . . 0.0 115.639 177.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -61.12 -55.61 30.49 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -174.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -74.58 -26.26 59.81 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 117.632 -1.627 . . . . 0.0 109.662 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 54.0 mt -56.86 -34.66 44.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 124.652 1.181 . . . . 0.0 109.144 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 38.9 mttt -55.79 -55.4 32.86 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 120.172 1.351 . . . . 0.0 110.063 175.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 5.2 t -67.98 -34.91 77.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.501 0.32 . . . . 0.0 110.507 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -63.63 -42.42 98.15 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.227 -0.921 . . . . 0.0 109.236 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 56.4 mt -69.95 -23.52 63.2 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.167 1.387 . . . . 0.0 111.45 175.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -74.89 -51.02 14.93 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 174.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 40.7 mtpt -53.24 -56.73 14.16 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.025 1.33 . . . . 0.0 109.765 175.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.77 -14.27 62.41 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.892 0.877 . . . . 0.0 112.656 178.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -84.54 -67.79 1.42 Allowed Glycine 0 C--N 1.333 0.368 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 148.05 164.16 11.18 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 129.399 3.38 . . . . 0.0 107.747 -175.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -153.57 167.5 29.3 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.429 1.092 . . . . 0.0 109.121 176.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -154.25 153.54 31.9 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 128.845 2.858 . . . . 0.0 105.859 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -148.26 88.79 1.67 Allowed 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 105.239 -2.134 . . . . 0.0 105.239 175.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -154.04 143.95 21.87 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 127.324 2.25 . . . . 0.0 105.529 176.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.63 69.24 0.6 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.896 0.771 . . . . 0.0 112.322 -176.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -146.56 170.21 17.37 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.151 0.887 . . . . 0.0 109.344 175.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.5 m 86.24 23.66 0.07 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 129.826 3.25 . . . . 0.0 109.699 -175.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 . . . . . 0 C--O 1.247 0.963 0 C-N-CA 131.586 3.954 . . . . 0.0 102.726 175.474 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.649 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.1 tt -76.02 123.4 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -174.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 29.2 ttm105 -126.73 129.72 48.95 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 175.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 9.8 mtt -71.54 69.87 0.63 Allowed 'General case' 0 C--O 1.236 0.395 0 C-N-CA 126.038 1.735 . . . . 0.0 109.977 176.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.42 146.29 43.01 Favored 'General case' 0 C--O 1.238 0.48 0 O-C-N 121.684 -0.635 . . . . 0.0 109.626 177.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.828 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.5 m -66.99 165.59 15.31 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 175.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -123.93 -176.13 3.4 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.526 -1.359 . . . . 0.0 111.327 -175.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -143.64 156.62 16.41 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 124.002 0.921 . . . . 0.0 110.45 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -100.79 85.74 2.95 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 102.587 -3.116 . . . . 0.0 102.587 174.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -65.46 -32.26 73.78 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 117.927 -1.035 . . . . 0.0 111.962 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -67.76 -50.49 56.85 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 119.847 1.203 . . . . 0.0 109.815 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.03 -45.9 76.06 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -177.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.7 m -72.31 -30.86 65.18 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 118.754 -0.641 . . . . 0.0 111.297 -177.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 51.1 ttm-85 -67.34 -31.99 72.62 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 116.952 -1.499 . . . . 0.0 108.84 175.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.09 -60.0 3.99 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 120.494 1.497 . . . . 0.0 109.744 -178.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.98 -38.86 89.61 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.171 0.442 . . . . 0.0 111.529 -177.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -56.5 -41.69 77.11 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 122.736 0.414 . . . . 0.0 110.219 176.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -62.03 -45.93 91.4 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 124.61 1.164 . . . . 0.0 110.27 -177.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.84 -59.8 4.86 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 175.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.543 HG21 HG23 ' A' ' 30' ' ' VAL . 11.5 t -60.96 -26.1 37.92 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 CA-C-O 117.93 -1.033 . . . . 0.0 111.236 -176.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.476 HH11 ' HG3' ' A' ' 21' ' ' ARG . 1.7 ttt85 -66.79 -39.47 87.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 119.933 1.242 . . . . 0.0 110.097 175.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -64.92 123.9 20.63 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.0 -29.16 67.04 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.499 1.119 . . . . 0.0 111.111 176.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.17 -10.13 66.53 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 118.135 -1.369 . . . . 0.0 114.177 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.5 t -71.21 135.62 47.62 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 120.292 2.046 . . . . 0.0 108.05 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.01 -25.99 67.97 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.502 175.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.0 t -75.48 123.69 31.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 105.98 -1.859 . . . . 0.0 105.98 175.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.03 -25.12 3.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 C-N-CA 123.125 0.57 . . . . 0.0 110.333 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.1 p-90 -125.33 147.21 49.23 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 119.113 0.869 . . . . 0.0 109.25 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.543 HG23 HG21 ' A' ' 20' ' ' VAL . 5.5 t -139.83 162.96 25.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 128.032 2.533 . . . . 0.0 107.306 178.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 80.7 p -128.33 161.55 29.15 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 175.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -133.6 123.69 25.54 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.5 mmtt -94.37 176.41 6.31 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 176.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -118.93 142.9 47.36 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 175.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -137.1 152.48 50.05 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 175.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 32.86 -98.96 0.01 OUTLIER Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.629 2.061 . . . . 0.0 113.646 176.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.29 39.44 3.25 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.058 1.743 . . . . 0.0 110.467 176.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -142.08 175.69 9.54 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.508 1.123 . . . . 0.0 111.503 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 32.0 mm -107.31 135.52 45.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 104.729 -2.322 . . . . 0.0 104.729 175.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.4 m -129.47 158.05 74.48 Favored Pre-proline 0 N--CA 1.47 0.532 0 CA-C-O 118.741 -0.647 . . . . 0.0 110.472 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.71 165.4 32.84 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 121.962 1.775 . . . . 0.0 110.355 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -134.16 -157.86 8.35 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 125.485 1.517 . . . . 0.0 110.557 176.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.8 mp0 -59.03 158.44 8.57 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 125.212 1.405 . . . . 0.0 109.398 176.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.401 ' HB3' HG22 ' A' ' 30' ' ' VAL . 3.6 pt20 -156.78 155.59 31.84 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.768 1.227 . . . . 0.0 108.107 -176.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.7 -179.15 40.73 Favored Glycine 0 CA--C 1.527 0.782 0 CA-C-O 121.589 0.549 . . . . 0.0 113.156 -175.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.85 -26.24 11.33 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.101 1.36 . . . . 0.0 112.186 177.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -111.77 128.94 56.25 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 -175.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -83.08 -10.61 58.61 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.611 1.964 . . . . 0.0 113.11 -175.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -53.96 -37.98 64.49 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 120.06 1.3 . . . . 0.0 110.572 175.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -69.01 -34.06 74.65 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.413 1.085 . . . . 0.0 111.602 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -58.48 -39.23 79.41 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.559 1.144 . . . . 0.0 109.51 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.9 mm -59.79 -32.55 49.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 123.874 0.87 . . . . 0.0 109.173 -176.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -79.31 -24.05 43.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.034 1.334 . . . . 0.0 112.441 -176.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -80.94 -23.55 38.77 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.634 1.174 . . . . 0.0 112.609 -175.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 79.6 m -79.39 114.47 18.35 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.777 1.231 . . . . 0.0 108.918 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.2 p -130.16 -173.6 3.09 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 122.475 1.131 . . . . 0.0 111.259 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.4 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 9.6 p-10 -40.77 -76.57 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.49 1 C-N-CA 134.673 5.189 . . . . 0.0 117.67 -175.862 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.4 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 17.2 t70 -106.21 -6.46 18.47 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 125.958 1.703 . . . . 0.0 114.077 -175.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.8 m -68.69 131.32 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 O-C-N 120.816 -1.177 . . . . 0.0 110.063 -176.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.6 ptt-85 -103.95 123.51 47.3 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 101.216 -3.624 . . . . 0.0 101.216 175.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.6 tp -141.76 163.21 33.53 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 123.619 0.767 . . . . 0.0 110.01 -175.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -131.48 152.12 50.98 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.509 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -142.32 163.75 32.02 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.315 0.579 . . . . 0.0 111.274 176.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -138.06 123.68 19.75 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 105.3 -2.111 . . . . 0.0 105.3 -176.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.0 t -133.72 138.46 50.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -175.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.1 ttp-105 -80.91 114.9 20.11 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 175.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -131.85 133.33 44.53 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.615 1.166 . . . . 0.0 108.986 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m -95.82 131.77 41.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 122.232 1.015 . . . . 0.0 111.034 -176.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 34.7 m -83.72 132.62 34.84 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 104.673 -2.343 . . . . 0.0 104.673 175.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -37.67 131.72 1.3 Allowed Glycine 0 C--N 1.339 0.7 0 C-N-CA 125.451 1.5 . . . . 0.0 110.798 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -50.43 166.1 0.08 Allowed 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 127.265 2.226 . . . . 0.0 116.898 -175.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.17 -173.21 4.11 Favored 'General case' 0 N--CA 1.447 -0.592 1 C-N-CA 133.072 4.549 . . . . 0.0 103.184 175.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 92.8 mtp -60.59 2.9 0.09 Allowed 'General case' 0 CA--C 1.552 1.021 0 O-C-N 120.651 -1.28 . . . . 0.0 112.706 175.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 69.3 m -146.31 145.36 30.31 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 127.778 2.431 . . . . 0.0 106.788 175.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.3 mmtm -64.5 167.73 6.71 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.49 1.138 . . . . 0.0 112.82 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.48 148.12 42.25 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 175.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.6 t -146.51 123.92 11.67 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 104.513 -2.403 . . . . 0.0 104.513 175.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.6 mttt -135.93 176.37 8.75 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -175.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -132.31 127.17 35.03 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.037 -176.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.57 117.76 34.84 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.883 1.673 . . . . 0.0 106.82 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -87.11 113.31 22.75 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 104.3 -2.481 . . . . 0.0 104.3 175.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mt -98.23 146.55 7.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 -176.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.2 m -126.03 123.58 38.76 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 103.317 -2.846 . . . . 0.0 103.317 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 25.6 t-105 -103.28 123.46 46.82 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 175.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.437 HD11 HG21 ' A' ' 97' ' ' THR . 13.3 mm -143.03 101.44 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 N-CA-C 105.386 -2.079 . . . . 0.0 105.386 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -60.42 154.63 33.85 Favored Glycine 0 CA--C 1.535 1.303 0 N-CA-C 108.329 -1.909 . . . . 0.0 108.329 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -74.57 -3.35 30.51 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 120.342 -1.681 . . . . 0.0 111.177 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -82.95 -36.01 25.52 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 120.833 -1.167 . . . . 0.0 109.248 -175.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -70.91 123.82 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 104.921 -2.252 . . . . 0.0 104.921 175.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.9 t -78.52 171.74 14.68 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 122.759 1.266 . . . . 0.0 113.547 -174.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -46.84 -35.36 7.76 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 129.12 3.248 . . . . 0.0 113.661 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 tt -62.49 -57.38 11.41 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 119.937 1.869 . . . . 0.0 110.719 176.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -66.1 -37.77 86.59 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 121.774 -0.579 . . . . 0.0 109.885 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -61.41 -33.1 73.13 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.832 -0.542 . . . . 0.0 110.012 175.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.4 -28.63 69.92 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 117.952 -1.023 . . . . 0.0 111.156 176.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -63.06 -55.47 25.2 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 175.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.437 HG21 HD11 ' A' ' 85' ' ' ILE . 13.0 m -50.33 -47.28 55.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.769 0.827 . . . . 0.0 109.764 175.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -59.62 -25.73 61.42 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.026 0.822 . . . . 0.0 114.263 178.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 49.5 m -103.12 -9.41 19.71 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 127.82 2.448 . . . . 0.0 111.155 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -104.52 -23.56 13.12 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 127.118 2.167 . . . . 0.0 112.238 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -48.36 -36.67 14.97 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 119.896 1.226 . . . . 0.0 113.061 176.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 4.0 t -59.76 -34.2 72.68 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.828 HD11 ' HB ' ' A' ' 6' ' ' THR . 15.4 mt -68.33 -61.66 1.74 Allowed 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 126.616 1.966 . . . . 0.0 109.963 -176.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.2 p -61.84 -30.4 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 117.502 -1.237 . . . . 0.0 108.489 175.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -41.69 99.52 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 120.76 1.618 . . . . 0.0 109.23 175.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -58.91 -25.63 63.58 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.46 1.027 . . . . 0.0 112.806 177.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 29.9 t -86.04 -54.07 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 59.1 t -76.09 21.93 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 C-N-CA 128.753 2.821 . . . . 0.0 112.218 -175.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -48.83 -22.76 0.88 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.862 1.665 . . . . 0.0 115.309 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -107.29 85.21 2.09 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -147.51 175.26 10.98 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.351 1.86 . . . . 0.0 108.524 176.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.14 -60.37 1.62 Allowed 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -175.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.49 173.76 12.01 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.873 1.269 . . . . 0.0 110.325 -178.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -126.59 158.62 35.78 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.452 1.101 . . . . 0.0 111.034 175.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -138.53 155.42 48.41 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 104.949 -2.241 . . . . 0.0 104.949 -175.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 46.8 t -128.53 130.11 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 175.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.5 mp -132.65 153.15 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 126.468 1.907 . . . . 0.0 107.099 -176.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.6 p -149.26 -9.85 0.32 Allowed 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.451 1.901 . . . . 0.0 114.443 -175.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -129.9 154.92 46.83 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.211 1.005 . . . . 0.0 110.756 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.58 HH12 ' CD ' ' A' ' 124' ' ' GLU . 0.0 OUTLIER -69.49 -29.75 67.47 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.587 -176.586 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -76.48 -46.59 26.11 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 121.501 1.955 . . . . 0.0 107.096 174.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -55.34 -23.9 26.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.916 2.087 . . . . 0.0 112.258 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -79.66 -22.87 42.98 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.747 1.619 . . . . 0.0 113.709 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.58 ' CD ' HH12 ' A' ' 120' ' ' ARG . 18.8 mt-10 -69.74 129.04 38.5 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 116.031 1.863 . . . . 0.0 116.031 -175.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.473 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 14.2 mm-40 -53.09 -17.47 1.58 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 125.538 1.535 . . . . 0.0 114.849 175.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.426 ' HA ' ' NZ ' ' A' ' 129' ' ' LYS 0.36 15.3 t70 -65.11 -57.95 7.29 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 117.657 -1.617 . . . . 0.0 112.756 -175.605 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -77.69 -26.3 50.14 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 117.949 -1.5 . . . . 0.0 109.907 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.473 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 51.7 mt -56.53 -40.89 71.07 Favored 'Isoleucine or valine' 0 C--N 1.344 0.345 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.426 ' NZ ' ' HA ' ' A' ' 126' ' ' ASP . 28.1 mtmm -52.85 -52.35 57.58 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 119.905 1.229 . . . . 0.0 111.283 176.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.2 t -73.79 -24.19 59.8 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.622 -178.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -67.63 -49.75 61.42 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 175.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.01 -23.9 62.34 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.29 1.036 . . . . 0.0 111.092 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -67.5 -52.93 33.3 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 174.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -53.73 -48.82 69.27 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.588 1.085 . . . . 0.0 110.103 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.27 -7.96 11.15 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.415 1.086 . . . . 0.0 112.378 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -98.48 -62.88 0.86 Allowed Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 107.082 -2.407 . . . . 0.0 107.082 175.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -167.89 -168.93 30.73 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.617 1.103 . . . . 0.0 111.149 -179.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.7 172.23 5.49 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.275 0.63 . . . . 0.0 111.398 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -136.92 103.72 5.25 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 103.85 -2.648 . . . . 0.0 103.85 175.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -130.66 116.27 17.84 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 103.013 -2.958 . . . . 0.0 103.013 -176.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -111.93 158.56 19.33 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 128.278 2.631 . . . . 0.0 104.694 175.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -73.74 86.43 1.68 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.79 0.723 . . . . 0.0 110.224 -175.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -136.69 91.41 2.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.065 1.346 . . . . 0.0 109.277 -175.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 86.46 56.4 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 127.307 2.243 . . . . 0.0 110.448 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 . . . . . 0 C--O 1.249 1.067 0 N-CA-C 104.344 -2.465 . . . . 0.0 104.344 175.464 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.649 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.5 mt -80.4 91.05 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 173.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.17 81.11 1.06 Allowed 'General case' 0 N--CA 1.466 0.332 0 O-C-N 120.999 -1.063 . . . . 0.0 109.778 176.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.18 176.02 9.63 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.641 0.777 . . . . 0.0 111.36 -175.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -137.29 56.26 1.79 Allowed 'General case' 0 C--O 1.236 0.384 0 N-CA-C 105.424 -2.065 . . . . 0.0 105.424 175.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.708 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.4 m -134.29 165.24 25.58 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.035 1.734 . . . . 0.0 106.412 -175.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -128.03 178.45 6.19 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.115 -0.991 . . . . 0.0 111.006 -175.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.417 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -138.19 151.35 24.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 122.732 0.413 . . . . 0.0 110.095 176.639 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -99.74 77.73 2.08 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 103.076 -2.935 . . . . 0.0 103.076 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -24.13 66.46 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.027 -1.463 . . . . 0.0 110.47 -175.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -66.46 -59.88 3.26 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 120.228 1.377 . . . . 0.0 109.799 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.62 93.15 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.979 0.912 . . . . 0.0 109.853 -178.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.473 ' HB3' HG11 ' A' ' 107' ' ' VAL . 62.5 m -66.78 -36.94 83.58 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.361 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 68.9 ttt-85 -63.7 -35.45 80.61 Favored 'General case' 0 C--N 1.345 0.405 0 CA-C-N 119.11 0.868 . . . . 0.0 109.111 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.47 -50.61 72.49 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.526 0.603 . . . . 0.0 109.965 -175.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.525 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -67.39 -44.88 77.82 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 122.435 0.294 . . . . 0.0 111.781 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -51.35 -39.3 56.77 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.646 1.178 . . . . 0.0 111.444 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -65.9 -42.41 90.24 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.399 0.68 . . . . 0.0 111.258 -178.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.3 mp -61.95 -54.87 35.77 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 123.428 0.691 . . . . 0.0 109.977 175.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.433 ' CG2' HG23 ' A' ' 30' ' ' VAL . 13.6 t -55.67 -36.18 41.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 122.83 0.452 . . . . 0.0 111.131 178.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -65.69 -38.25 88.74 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.129 176.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -76.2 123.18 25.45 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 120.166 1.348 . . . . 0.0 109.515 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -67.77 -19.53 65.11 Favored 'General case' 0 CA--C 1.529 0.167 0 O-C-N 121.338 -0.851 . . . . 0.0 111.289 175.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.88 -11.23 84.09 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.801 1.191 . . . . 0.0 112.538 176.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.8 t -74.13 143.24 45.41 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 175.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -72.37 -14.58 61.75 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.475 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.6 t -86.19 136.59 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 126.825 2.05 . . . . 0.0 109.12 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.53 -27.36 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 124.436 1.094 . . . . 0.0 110.127 175.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -130.91 154.2 48.35 Favored 'General case' 0 C--N 1.343 0.318 0 CA-C-N 119.836 1.198 . . . . 0.0 111.261 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.525 HG21 ' HB1' ' A' ' 16' ' ' ALA . 5.7 t -139.33 160.94 28.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 128.32 2.648 . . . . 0.0 107.542 176.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 45.1 p -122.41 153.7 38.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 175.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -123.29 123.94 41.86 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 175.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -106.46 175.98 5.32 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 105.222 -2.14 . . . . 0.0 105.222 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -115.06 152.41 32.55 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 175.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -147.59 124.2 11.1 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 107.208 -1.405 . . . . 0.0 107.208 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 53.24 -84.51 0.01 OUTLIER Glycine 0 CA--C 1.53 1.02 0 C-N-CA 126.003 1.764 . . . . 0.0 114.857 176.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.8 p -136.07 25.25 3.29 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.988 1.315 . . . . 0.0 112.009 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -145.7 169.81 17.73 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 119.177 0.899 . . . . 0.0 112.229 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.3 mm -96.48 138.38 21.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 104.282 -2.488 . . . . 0.0 104.282 175.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.3 m -130.79 147.89 67.96 Favored Pre-proline 0 CA--C 1.531 0.25 0 C-N-CA 122.822 0.449 . . . . 0.0 110.947 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.73 139.99 34.79 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 121.566 1.511 . . . . 0.0 108.457 175.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -110.67 -147.65 11.31 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 125.506 1.527 . . . . 0.0 109.793 176.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -59.28 160.3 6.72 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 123.763 0.825 . . . . 0.0 111.179 175.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -141.28 166.06 25.82 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 126.137 1.775 . . . . 0.0 108.641 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.27 179.41 41.38 Favored Glycine 0 N--CA 1.452 -0.291 0 O-C-N 121.593 -0.692 . . . . 0.0 113.033 -175.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -124.14 -12.8 7.37 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 125.559 1.544 . . . . 0.0 113.476 -175.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -131.98 144.82 51.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -83.5 -9.04 59.22 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.429 0.691 . . . . 0.0 110.518 -174.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -58.31 -37.02 74.24 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.327 -1.483 . . . . 0.0 110.219 175.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 19.4 m80 -76.04 -29.34 58.03 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.261 1.024 . . . . 0.0 110.549 175.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -60.51 -32.87 71.87 Favored 'General case' 0 C--O 1.232 0.172 0 O-C-N 121.565 -0.71 . . . . 0.0 111.994 178.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.5 mm -57.6 -35.62 51.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.4 mm-40 -71.87 -23.57 61.53 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.287 1.435 . . . . 0.0 112.345 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -65.03 -34.62 78.87 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 120.842 -1.161 . . . . 0.0 110.688 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.63 112.86 19.21 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 -176.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.3 p -113.82 172.53 6.92 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.753 1.621 . . . . 0.0 112.66 -175.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -46.38 -71.36 0.07 Allowed 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 118.267 2.691 . . . . 0.0 118.267 -174.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -106.58 -31.34 8.54 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -175.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.8 m -70.88 153.3 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.95 0 O-C-N 120.991 -1.068 . . . . 0.0 110.896 -175.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.87 148.16 26.47 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 175.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.3 tp -145.93 162.98 36.55 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.478 1.111 . . . . 0.0 109.495 -175.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -128.16 152.51 47.95 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.429 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.96 143.89 29.78 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 118.34 0.518 . . . . 0.0 112.137 176.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -109.88 123.73 50.1 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 176.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.5 t -133.02 138.99 50.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 C-N-CA 122.72 0.408 . . . . 0.0 111.564 -175.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -79.95 120.5 24.24 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 104.187 -2.523 . . . . 0.0 104.187 175.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -135.92 164.2 28.49 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -177.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 86.0 m -116.38 117.48 30.05 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 -176.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 3.3 m -152.04 158.42 43.03 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.12 164.78 7.32 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 125.081 1.324 . . . . 0.0 111.206 -178.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -142.67 155.17 44.88 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 123.626 0.77 . . . . 0.0 109.264 176.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.35 -173.38 4.17 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.03 2.932 . . . . 0.0 105.516 176.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 86.7 mtp -65.88 7.17 0.29 Allowed 'General case' 0 CA--C 1.551 0.999 0 O-C-N 121.223 -0.923 . . . . 0.0 111.642 175.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.9 m -146.07 176.31 9.81 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 129.569 3.147 . . . . 0.0 106.633 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.5 mmpm? -77.23 175.56 9.58 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 119.828 -1.795 . . . . 0.0 110.188 175.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -136.72 161.28 36.37 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.169 0.987 . . . . 0.0 108.712 -175.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.8 t -144.58 123.75 12.92 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 175.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mtpt -132.06 123.39 27.13 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 -175.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -86.06 129.39 34.86 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.088 -175.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -104.04 126.02 50.84 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -94.78 113.31 25.06 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 102.759 -3.052 . . . . 0.0 102.759 175.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.8 mp -95.13 143.53 11.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.2 m -125.42 123.22 38.8 Favored 'General case' 0 N--CA 1.435 -1.203 0 N-CA-C 102.66 -3.089 . . . . 0.0 102.66 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -99.67 124.52 44.98 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 104.039 -2.578 . . . . 0.0 104.039 175.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.538 HD11 HG21 ' A' ' 97' ' ' THR . 5.2 mt -139.2 78.62 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 178.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -42.75 137.53 3.39 Favored Glycine 0 C--N 1.339 0.725 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -176.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -62.19 -4.07 1.58 Allowed 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 118.369 1.085 . . . . 0.0 112.485 -175.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -83.12 -35.98 25.17 Favored 'General case' 0 CA--C 1.521 -0.153 0 O-C-N 120.402 -1.437 . . . . 0.0 109.889 178.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.9 p -78.35 123.73 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 119.889 1.222 . . . . 0.0 109.084 175.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.3 t -146.05 123.63 11.78 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 175.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 133.26 -151.11 19.99 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 124.254 0.931 . . . . 0.0 111.084 -175.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -50.4 -38.5 43.23 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 126.193 1.797 . . . . 0.0 111.656 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -61.38 -38.11 85.83 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.169 1.35 . . . . 0.0 111.484 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.0 ttm180 -71.47 -37.29 71.34 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.751 1.16 . . . . 0.0 108.322 175.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.48 -31.57 72.77 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 118.788 -0.625 . . . . 0.0 111.849 178.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -59.51 -54.27 48.47 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 119.457 1.026 . . . . 0.0 108.394 176.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.538 HG21 HD11 ' A' ' 85' ' ' ILE . 15.8 m -52.16 -40.97 62.18 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.573 0.624 . . . . 0.0 110.367 175.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -58.77 -25.83 59.45 Favored Glycine 0 CA--C 1.525 0.681 0 CA-C-O 119.736 -0.48 . . . . 0.0 113.768 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 50.8 m -115.16 -0.29 13.33 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.568 1.184 . . . . 0.0 111.657 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -103.49 -23.14 13.54 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 125.71 1.604 . . . . 0.0 108.775 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -53.33 -24.43 11.87 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 120.111 1.323 . . . . 0.0 110.437 174.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -64.09 -41.99 97.09 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.246 -0.909 . . . . 0.0 110.639 176.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.708 HD11 ' HB ' ' A' ' 6' ' ' THR . 12.4 mt -62.82 -62.23 1.87 Allowed 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 125.363 1.465 . . . . 0.0 109.007 -176.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.257 0.9 OUTLIER -57.45 -31.32 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-O 117.501 -1.237 . . . . 0.0 110.702 176.353 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -60.92 -47.58 85.74 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 121.195 1.816 . . . . 0.0 109.8 175.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -54.37 -24.01 17.88 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.089 0.956 . . . . 0.0 111.539 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.473 HG11 ' HB3' ' A' ' 13' ' ' CYS . 61.5 t -86.15 -65.38 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.653 1.181 . . . . 0.0 108.036 175.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 98.1 t -64.8 25.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.814 1 C-N-CA 131.957 4.103 . . . . 0.0 113.747 -175.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -49.42 -26.6 3.39 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 115.553 1.686 . . . . 0.0 115.553 -175.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -105.49 84.44 2.09 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -138.13 176.52 8.63 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 124.787 1.235 . . . . 0.0 108.293 176.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -104.65 -62.38 1.34 Allowed 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.31 0.644 . . . . 0.0 109.869 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -156.45 175.79 13.55 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 127.554 2.342 . . . . 0.0 106.879 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -117.31 170.58 8.59 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 125.024 1.33 . . . . 0.0 111.077 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -141.67 150.54 42.03 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 105.187 -2.153 . . . . 0.0 105.187 -176.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 65.2 t -124.27 128.7 73.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 175.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.4 mp -129.13 142.15 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 125.562 1.545 . . . . 0.0 107.182 -178.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 60.6 p -135.13 -3.26 2.48 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 175.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -130.85 149.7 52.36 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.094 1.758 . . . . 0.0 109.652 -175.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 14.0 ttp85 -69.46 -30.64 68.58 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.608 -0.71 . . . . 0.0 111.125 -176.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -73.47 -39.01 65.24 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 120.232 1.378 . . . . 0.0 109.095 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -63.86 -23.7 67.46 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.127 0.971 . . . . 0.0 110.35 175.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -71.93 -22.35 61.48 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.741 -1.224 . . . . 0.0 112.571 176.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -61.28 123.81 18.8 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -176.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.407 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 2.9 mm-40 -56.12 -31.59 63.45 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.232 1.013 . . . . 0.0 113.462 175.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -55.48 -43.28 75.39 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -175.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -94.9 -25.87 16.39 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 119.82 1.191 . . . . 0.0 109.473 176.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.407 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 14.9 mt -51.98 -39.7 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 124.782 1.233 . . . . 0.0 107.995 176.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -51.46 -52.29 47.7 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.764 0.711 . . . . 0.0 110.64 175.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -68.23 -40.62 81.99 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.38 0.536 . . . . 0.0 110.583 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -61.47 -39.21 90.06 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.315 -0.866 . . . . 0.0 111.263 178.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.4 mt -73.08 -40.42 65.03 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.767 1.227 . . . . 0.0 110.314 176.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -56.8 -44.54 82.04 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 175.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -61.75 -49.23 77.24 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.339 1.055 . . . . 0.0 109.208 175.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.84 -22.62 64.4 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -177.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -56.78 -46.49 89.79 Favored Glycine 0 CA--C 1.529 0.958 0 O-C-N 121.305 -0.872 . . . . 0.0 112.745 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -75.19 92.05 0.84 Allowed Glycine 0 C--N 1.335 0.499 0 N-CA-C 108.827 -1.709 . . . . 0.0 108.827 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -158.33 164.66 36.16 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 118.328 1.064 . . . . 0.0 110.528 -178.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -85.24 93.6 8.71 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.964 1.306 . . . . 0.0 110.088 177.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -155.2 116.33 3.97 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.904 2.082 . . . . 0.0 107.193 -176.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -131.59 157.93 42.34 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.069 1.748 . . . . 0.0 108.909 175.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -153.5 79.41 1.16 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.551 1.54 . . . . 0.0 109.503 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.6 mm-40 -70.65 40.68 0.06 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.984 2.114 . . . . 0.0 112.375 175.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 64.51 23.45 12.91 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.831 1.653 . . . . 0.0 110.507 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 125.136 1.374 . . . . 0.0 109.038 -176.323 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.065 0 CA-C-O 118.791 -1.005 . . . . 0.0 112.695 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.6 pt -144.59 62.34 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 125.528 1.531 . . . . 0.0 108.139 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.95 23.74 11.79 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 120.539 -1.351 . . . . 0.0 112.986 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -86.77 176.31 7.79 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.175 0.898 . . . . 0.0 109.966 175.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -138.99 95.85 3.02 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 104.194 -2.521 . . . . 0.0 104.194 175.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.71 ' HB ' HD11 ' A' ' 103' ' ' LEU . 10.0 m -134.17 178.47 6.94 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.081 1.352 . . . . 0.0 108.328 -175.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.3 tttp -127.35 175.45 8.18 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.197 -0.94 . . . . 0.0 111.58 -175.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -139.97 148.2 23.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 C-N-CA 125.993 1.717 . . . . 0.0 107.851 175.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -91.57 79.47 5.48 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 103.478 -2.786 . . . . 0.0 103.478 175.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -60.64 -23.47 64.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 116.92 -1.514 . . . . 0.0 113.577 -175.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -76.33 -56.79 4.31 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.813 1.642 . . . . 0.0 109.309 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.43 89.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 119.727 -0.178 . . . . 0.0 111.473 -175.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 100.0 m -72.08 -33.85 68.22 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.474 -0.766 . . . . 0.0 111.082 176.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -24.89 66.52 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 117.856 -1.069 . . . . 0.0 110.704 176.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.68 -59.07 5.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 120.387 1.449 . . . . 0.0 110.146 176.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.34 -39.01 91.7 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.651 -0.656 . . . . 0.0 111.216 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -55.92 -47.11 78.08 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 118.438 -0.792 . . . . 0.0 109.532 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -54.67 -47.15 73.96 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 124.971 1.308 . . . . 0.0 110.351 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.3 mp -60.11 -53.97 51.48 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 118.465 0.575 . . . . 0.0 111.088 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 40.4 t -65.02 -24.28 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 O-C-N 121.19 -0.944 . . . . 0.0 111.352 -178.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -51.59 10.48 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 125.321 1.448 . . . . 0.0 110.719 176.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.68 123.71 21.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.693 0.679 . . . . 0.0 112.442 -175.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -67.84 -9.17 42.26 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.874 0.87 . . . . 0.0 113.101 -176.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -91.43 -0.57 72.96 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 119.438 1.017 . . . . 0.0 112.491 176.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.5 t -80.79 145.46 31.45 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 119.055 1.428 . . . . 0.0 111.029 178.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -80.47 -35.84 34.26 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.0 127.81 27.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 C-N-CA 125.669 1.587 . . . . 0.0 108.264 176.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -115.75 -23.87 3.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 125.002 1.321 . . . . 0.0 110.991 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -124.98 143.34 50.94 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.594 1.158 . . . . 0.0 108.836 -177.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.7 t -137.16 165.25 28.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 127.647 2.379 . . . . 0.0 109.44 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 82.8 p -132.9 156.33 47.42 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.725 1.21 . . . . 0.0 108.125 175.274 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -128.43 124.47 36.32 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 176.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -99.88 176.32 5.48 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -115.85 145.1 43.15 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 104.939 -2.245 . . . . 0.0 104.939 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -133.58 123.52 25.26 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.218 -2.512 . . . . 0.0 104.218 176.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 36.48 -96.96 0.01 OUTLIER Glycine 0 CA--C 1.533 1.167 0 C-N-CA 126.469 1.985 . . . . 0.0 113.22 -175.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 p -120.18 35.34 4.89 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.681 1.592 . . . . 0.0 113.197 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -146.49 168.74 20.45 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.31 1.044 . . . . 0.0 111.239 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.2 mm -100.14 138.49 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 175.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.7 m -134.08 161.43 63.79 Favored Pre-proline 0 N--CA 1.473 0.706 0 C-N-CA 123.587 0.755 . . . . 0.0 111.688 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.96 155.93 66.94 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 121.896 1.73 . . . . 0.0 108.469 175.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.02 -144.98 7.13 Favored Glycine 0 CA--C 1.52 0.388 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 176.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -68.97 159.64 32.37 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 175.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -141.11 161.84 36.91 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 125.552 1.541 . . . . 0.0 107.349 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.49 -178.21 46.93 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-O 122.393 0.996 . . . . 0.0 113.155 176.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.97 -26.43 4.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.002 1.321 . . . . 0.0 110.313 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -94.9 123.26 38.26 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -83.12 -14.27 53.95 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.201 0.6 . . . . 0.0 110.599 -176.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -57.74 -38.06 74.67 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.561 -1.337 . . . . 0.0 110.065 175.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -68.68 -32.31 72.04 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.645 -0.659 . . . . 0.0 111.575 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -57.98 -31.92 67.38 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.479 1.112 . . . . 0.0 111.025 178.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 mm -63.97 -47.65 89.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -67.78 -23.62 65.23 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.897 0.879 . . . . 0.0 112.799 176.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -67.8 -25.86 65.8 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 119.975 1.261 . . . . 0.0 111.644 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 74.3 m -73.79 112.89 10.34 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.384 0.611 . . . . 0.0 109.654 -175.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.37 2.1 p -105.23 167.28 9.83 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 127.298 2.239 . . . . 0.0 111.437 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -54.12 -76.68 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 -174.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -100.76 -28.25 12.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 119.685 1.129 . . . . 0.0 113.574 -174.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.0 m -58.77 137.71 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 O-C-N 121.276 -0.89 . . . . 0.0 109.619 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.11 134.9 47.45 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 105.09 -2.189 . . . . 0.0 105.09 175.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.8 tp -130.19 161.99 29.9 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 124.684 1.194 . . . . 0.0 109.801 -175.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.411 ' CE2' HG11 ' A' ' 104' ' ' VAL . 11.6 m-85 -120.52 140.83 50.88 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -130.44 146.16 51.95 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 124.01 0.924 . . . . 0.0 108.856 176.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -123.74 123.62 40.91 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 103.562 -2.755 . . . . 0.0 103.562 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 t -138.07 146.61 26.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 118.917 0.781 . . . . 0.0 110.414 -175.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 20.2 ttm180 -79.69 123.99 28.16 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -128.82 170.75 12.99 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.917 1.287 . . . . 0.0 109.183 176.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 90.6 m -119.33 115.32 23.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 125.106 1.362 . . . . 0.0 107.864 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.9 m -151.83 141.99 22.28 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.346 -0.846 . . . . 0.0 110.645 176.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 87.61 157.18 31.14 Favored Glycine 0 CA--C 1.525 0.67 0 C-N-CA 126.116 1.817 . . . . 0.0 108.575 -177.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -135.77 141.16 44.77 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -176.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.47 -173.35 4.17 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 127.343 2.257 . . . . 0.0 106.942 175.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 58.4 mmm -64.94 -6.22 7.96 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.037 0.535 . . . . 0.0 111.28 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.4 m -132.52 166.92 20.96 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 129.61 3.164 . . . . 0.0 105.902 175.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -71.12 175.91 4.87 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 122.36 1.076 . . . . 0.0 108.937 175.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.1 mmt85 -132.52 150.21 52.19 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 175.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.1 t -125.12 128.92 49.18 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 103.511 -2.774 . . . . 0.0 103.511 175.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -136.08 123.91 22.6 Favored 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -177.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -91.6 128.11 37.3 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.565 -1.198 . . . . 0.0 108.589 -175.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -103.62 121.57 43.2 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 -176.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.79 113.37 23.39 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 105.048 -2.205 . . . . 0.0 105.048 175.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.0 mp -96.15 138.86 20.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 176.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -122.68 123.29 40.79 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 104.269 -2.493 . . . . 0.0 104.269 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 63.8 t-105 -92.13 123.33 35.4 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 104.224 -2.51 . . . . 0.0 104.224 175.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.463 HD11 HG21 ' A' ' 97' ' ' THR . 6.0 mt -150.16 92.06 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 176.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -57.63 174.97 2.01 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 123.933 0.778 . . . . 0.0 113.183 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -86.51 -9.24 56.59 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.47 -1.018 . . . . 0.0 110.67 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -83.86 -31.74 25.61 Favored 'General case' 0 C--O 1.238 0.475 0 O-C-N 121.022 -1.049 . . . . 0.0 109.142 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -65.7 146.39 13.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 118.73 0.695 . . . . 0.0 110.739 -177.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 39.9 t -74.62 151.78 39.31 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 125.602 1.561 . . . . 0.0 110.812 -177.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.2 -28.87 69.82 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 123.907 0.765 . . . . 0.0 111.469 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.2 tt -62.39 -47.96 81.81 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 118.284 1.042 . . . . 0.0 109.653 176.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -65.46 -46.47 79.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.697 -0.668 . . . . 0.0 109.853 175.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.01 -27.9 61.99 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.45 1.023 . . . . 0.0 111.82 177.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.64 -36.68 85.03 Favored 'General case' 0 C--O 1.234 0.272 0 O-C-N 120.7 -1.25 . . . . 0.0 112.104 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -57.02 -46.42 82.37 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 118.641 -0.695 . . . . 0.0 109.515 176.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.463 HG21 HD11 ' A' ' 85' ' ' ILE . 7.2 m -55.38 -42.46 74.0 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 123.66 0.784 . . . . 0.0 109.781 -177.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -70.66 -26.35 74.21 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 119.195 0.907 . . . . 0.0 113.135 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 86.0 m -86.05 -15.95 39.67 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.768 1.227 . . . . 0.0 111.419 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -103.5 -23.73 13.49 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 127.458 2.303 . . . . 0.0 113.225 -175.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -50.0 -27.91 6.16 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.29 1.405 . . . . 0.0 113.004 176.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.2 t -62.88 -38.64 91.68 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.499 1.045 . . . . 0.0 112.072 176.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.71 HD11 ' HB ' ' A' ' 6' ' ' THR . 12.4 mt -65.17 -61.33 2.2 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 125.419 1.488 . . . . 0.0 109.658 -176.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 104' ' ' VAL 0.257 0.8 OUTLIER -58.63 -28.96 38.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-O 118.117 -0.944 . . . . 0.0 109.262 175.636 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.01 -39.52 94.3 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 120.534 1.515 . . . . 0.0 109.653 175.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -54.52 -32.37 58.01 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 120.19 1.359 . . . . 0.0 112.988 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 52.5 t -86.44 -60.01 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 125.123 1.369 . . . . 0.0 111.022 176.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 3.5 t -74.32 26.62 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 129.193 2.997 . . . . 0.0 113.545 -175.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -53.61 -13.58 0.68 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 120.183 -1.573 . . . . 0.0 114.169 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -94.99 29.43 2.41 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 120.113 1.324 . . . . 0.0 113.08 175.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.37 174.12 9.32 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 175.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -123.69 -45.62 2.03 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.672 -0.642 . . . . 0.0 110.974 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.72 175.6 8.67 Favored 'General case' 0 C--O 1.235 0.29 1 C-N-CA 131.842 4.057 . . . . 0.0 106.333 175.811 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -132.1 171.4 13.68 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.82 0.848 . . . . 0.0 111.267 -178.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -146.85 149.98 34.35 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 40.3 t -123.62 124.22 68.99 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 175.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.7 mt -122.12 146.01 27.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 125.701 1.6 . . . . 0.0 109.521 -175.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 12.8 p -140.08 -8.45 1.18 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.493 1.294 . . . . 0.0 114.493 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -137.41 154.4 49.97 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.743 1.156 . . . . 0.0 109.32 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 29.1 ttp-105 -50.6 -46.53 58.01 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 124.165 0.986 . . . . 0.0 110.733 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -63.45 -38.19 90.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 118.587 0.63 . . . . 0.0 110.295 -176.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -72.62 -23.92 61.0 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.81 1.244 . . . . 0.0 110.491 177.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -79.57 -23.72 42.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.923 1.689 . . . . 0.0 111.527 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -69.77 123.56 21.74 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.099 1.318 . . . . 0.0 110.543 -176.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.1 -13.87 14.03 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.813 1.245 . . . . 0.0 113.717 -178.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -56.09 -65.93 0.52 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.363 1.865 . . . . 0.0 112.802 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -77.34 -25.86 51.49 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 118.263 -1.375 . . . . 0.0 108.815 -175.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 19.5 mt -50.21 -41.17 18.46 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 C-N-CA 125.569 1.548 . . . . 0.0 108.444 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 33.4 mttp -55.95 -56.33 21.94 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.582 -0.723 . . . . 0.0 111.054 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 43.4 t -67.76 -33.27 74.53 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.613 1.097 . . . . 0.0 110.754 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -60.86 -52.79 63.56 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.583 1.083 . . . . 0.0 109.791 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.8 mt -59.87 -41.05 90.67 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 124.656 1.183 . . . . 0.0 111.125 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -62.55 -52.58 62.87 Favored 'General case' 0 C--O 1.231 0.119 0 C-N-CA 123.645 0.778 . . . . 0.0 110.804 176.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -61.61 -45.84 92.35 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 119.331 0.969 . . . . 0.0 109.182 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.73 -0.03 6.36 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.508 1.123 . . . . 0.0 111.693 175.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -59.94 -26.37 63.03 Favored Glycine 0 CA--C 1.527 0.811 0 O-C-N 120.586 -1.321 . . . . 0.0 111.433 176.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -110.32 90.14 0.57 Allowed Glycine 0 C--N 1.337 0.602 0 N-CA-C 107.949 -2.06 . . . . 0.0 107.949 175.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -145.71 109.97 4.97 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 105.477 -2.045 . . . . 0.0 105.477 175.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -145.69 103.61 3.8 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -176.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -135.15 101.41 4.85 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.506 1.522 . . . . 0.0 110.32 -175.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -83.98 165.63 18.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.464 1.906 . . . . 0.0 110.479 175.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -144.82 136.14 25.21 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 127.022 2.129 . . . . 0.0 108.941 -178.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -127.55 94.64 4.02 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.544 1.065 . . . . 0.0 110.029 176.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.6 m 57.43 38.21 28.16 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.378 1.071 . . . . 0.0 111.016 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 . . . . . 0 C--O 1.248 1.012 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 175.427 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.217 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.8 pp -135.81 152.95 31.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-N 117.981 0.891 . . . . 0.0 111.022 -172.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 63.1 ttt-85 -150.96 166.65 29.99 Favored 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 106.166 -1.79 . . . . 0.0 106.166 175.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -67.53 24.78 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 127.058 2.143 . . . . 0.0 115.052 -175.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -122.76 43.99 2.77 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 123.195 1.474 . . . . 0.0 110.865 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.654 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.7 m -89.85 162.51 15.44 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 125.522 1.529 . . . . 0.0 107.868 176.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -133.45 -172.01 2.85 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 120.962 -1.086 . . . . 0.0 111.202 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.18 151.78 29.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 125.409 1.484 . . . . 0.0 108.964 175.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -86.7 79.0 9.0 Favored 'General case' 0 N--CA 1.464 0.272 1 N-CA-C 99.399 -4.297 . . . . 0.0 99.399 174.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.9 pttm -54.05 -35.4 61.97 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -74.49 -44.03 53.28 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 119.372 0.987 . . . . 0.0 109.469 -175.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.67 -45.86 73.99 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 118.13 0.423 . . . . 0.0 111.537 176.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 84.8 m -69.88 -41.6 74.56 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 119.382 -0.342 . . . . 0.0 110.574 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 -64.39 -32.29 73.85 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 116.631 -1.652 . . . . 0.0 109.777 175.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.87 -53.64 52.99 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 120.69 1.586 . . . . 0.0 110.029 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.443 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -56.23 -47.37 78.59 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.976 0.807 . . . . 0.0 110.98 176.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -55.54 -44.04 76.37 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.137 0.426 . . . . 0.0 111.005 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.54 -46.89 88.51 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 125.429 1.492 . . . . 0.0 109.612 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.2 mp -60.72 -46.57 89.88 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.789 0.722 . . . . 0.0 110.163 175.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.75 -39.38 81.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 123.598 0.759 . . . . 0.0 110.301 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -48.55 78.22 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -54.41 135.72 44.91 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 123.024 1.392 . . . . 0.0 113.032 -175.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -86.03 -22.69 27.12 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.679 1.992 . . . . 0.0 110.297 -178.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.35 -8.15 86.69 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.005 0.812 . . . . 0.0 112.947 176.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.7 t -81.21 139.62 35.41 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 118.653 1.226 . . . . 0.0 108.815 176.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -76.8 -35.65 57.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.311 0.644 . . . . 0.0 110.206 175.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.3 t -57.07 133.22 21.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 124.174 0.99 . . . . 0.0 108.935 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.09 -24.41 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 123.217 0.607 . . . . 0.0 109.656 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 49.3 p-90 -130.31 145.99 51.84 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 119.897 1.226 . . . . 0.0 110.366 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.443 HG11 ' HB1' ' A' ' 16' ' ' ALA . 49.9 t -137.28 168.42 21.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 175.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.43 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 76.5 p -132.02 161.01 34.23 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 175.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -135.19 123.9 23.77 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 104.76 -2.311 . . . . 0.0 104.76 -177.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -99.17 175.85 5.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 106.722 -1.585 . . . . 0.0 106.722 -176.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.448 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 24.0 m-85 -119.85 139.19 52.76 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 177.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -140.21 123.16 16.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 47.23 -98.47 0.01 OUTLIER Glycine 0 CA--C 1.526 0.768 0 C-N-CA 125.043 1.306 . . . . 0.0 113.818 -176.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 p -120.6 25.15 9.93 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.86 2.464 . . . . 0.0 111.745 -175.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -149.34 166.27 29.51 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.448 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 36.4 mm -92.88 133.1 35.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 175.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.7 m -126.7 160.95 55.97 Favored Pre-proline 0 N--CA 1.468 0.457 0 C-N-CA 123.406 0.682 . . . . 0.0 110.741 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.21 167.37 26.99 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 121.463 1.442 . . . . 0.0 109.11 175.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -139.23 -140.58 3.97 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.222 1.392 . . . . 0.0 112.13 -176.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -66.86 156.42 35.73 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 126.749 2.02 . . . . 0.0 110.228 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -149.29 158.27 44.03 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 125.02 1.328 . . . . 0.0 110.14 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -173.39 174.68 46.12 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 123.91 0.767 . . . . 0.0 112.672 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.77 -8.9 7.85 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.72 1.608 . . . . 0.0 112.686 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.22 135.1 55.19 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 104.278 -2.49 . . . . 0.0 104.278 177.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.401 ' CE1' ' CD2' ' A' ' 51' ' ' PHE . 41.0 t80 -86.29 -14.67 43.0 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -175.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -55.28 -44.86 76.07 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.474 1.488 . . . . 0.0 109.532 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -62.68 -22.97 66.88 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.256 1.022 . . . . 0.0 112.028 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.401 ' CD2' ' CE1' ' A' ' 48' ' ' TYR . 0.7 OUTLIER -62.51 -55.54 26.53 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.766 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.5 mp -64.02 -33.52 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.138 0.575 . . . . 0.0 109.815 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -62.49 -48.18 80.7 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -74.17 -22.43 59.42 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 -175.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 86.9 m -51.57 119.97 4.69 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 121.481 1.946 . . . . 0.0 110.727 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.5 p -101.54 164.18 11.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.458 1.503 . . . . 0.0 113.178 -175.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -49.77 -70.58 0.08 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 130.658 3.583 . . . . 0.0 119.251 -174.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -106.53 -36.49 6.75 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 124.845 1.258 . . . . 0.0 114.217 -175.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.6 m -58.39 145.36 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 CA-C-O 122.432 1.111 . . . . 0.0 110.397 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.72 139.64 38.69 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 175.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 57.4 tp -141.38 160.0 41.05 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 -176.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -126.55 123.52 37.9 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 105.057 -2.201 . . . . 0.0 105.057 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.43 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -104.45 162.23 13.42 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 175.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -137.25 123.15 20.12 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 102.188 -3.264 . . . . 0.0 102.188 178.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.8 t -129.21 134.52 63.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -175.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 41.2 ttt85 -77.1 113.54 14.94 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 105.115 -2.18 . . . . 0.0 105.115 175.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -116.64 173.77 6.44 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 126.368 1.867 . . . . 0.0 108.963 -175.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 37.0 m -133.52 117.14 16.79 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 121.278 -0.889 . . . . 0.0 109.887 -176.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 m -156.44 155.46 32.12 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 93.23 113.63 2.25 Favored Glycine 0 CA--C 1.501 -0.822 0 N-CA-C 105.121 -3.192 . . . . 0.0 105.121 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -109.95 122.5 47.7 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 110.62 -2.79 . . . . 0.0 108.461 -175.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.58 -173.79 4.3 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 126.047 1.739 . . . . 0.0 108.108 177.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 54.8 mtt -61.21 -1.21 0.44 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.131 1.772 . . . . 0.0 111.709 175.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.8 m -145.93 147.89 32.22 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 128.011 2.524 . . . . 0.0 105.366 175.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -69.26 167.05 17.14 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -138.44 167.9 20.91 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -177.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.3 t -125.58 158.37 34.8 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 175.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.5 mmmt -144.22 171.78 13.83 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 127.048 2.139 . . . . 0.0 107.475 -176.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -144.53 123.88 13.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.532 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.94 129.24 56.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 126.054 1.742 . . . . 0.0 108.432 -176.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -98.57 113.8 25.99 Favored 'General case' 0 C--O 1.222 -0.342 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 175.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.1 mt -103.63 137.57 31.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 -177.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -116.05 122.89 46.51 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 175.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.0 t-105 -97.04 123.29 40.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 103.833 -2.654 . . . . 0.0 103.833 175.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.1 mt -145.56 98.12 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 176.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -59.94 162.86 16.18 Favored Glycine 0 CA--C 1.53 0.992 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -76.08 -6.41 51.0 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 121.07 -1.253 . . . . 0.0 110.998 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -83.2 -35.98 25.03 Favored 'General case' 0 C--N 1.341 0.231 0 O-C-N 121.423 -0.798 . . . . 0.0 109.589 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.7 p -71.56 127.62 33.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 176.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 48.3 t -63.32 153.44 34.94 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 124.28 1.032 . . . . 0.0 110.805 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -51.28 -29.94 23.71 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 125.678 1.608 . . . . 0.0 113.054 176.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.95 -51.66 69.11 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.355 1.078 . . . . 0.0 110.232 176.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -70.28 -31.49 68.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 118.51 -0.757 . . . . 0.0 110.036 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -63.41 -28.84 70.25 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.757 1.162 . . . . 0.0 109.273 175.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.89 -24.13 61.91 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.569 1.148 . . . . 0.0 111.958 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.36 -35.4 69.9 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 118.787 0.721 . . . . 0.0 110.481 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.7 m -54.8 -33.35 61.41 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.345 1.058 . . . . 0.0 110.146 175.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.33 -14.27 61.67 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 125.547 1.546 . . . . 0.0 114.481 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 30.0 m -123.18 -3.87 8.48 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.462 1.631 . . . . 0.0 109.894 175.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -103.79 -37.97 7.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 123.919 0.888 . . . . 0.0 112.684 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.5 mtmp? -57.18 -36.9 71.37 Favored 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 120.257 1.39 . . . . 0.0 111.376 -176.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -56.87 -34.06 67.46 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 120.255 1.388 . . . . 0.0 112.046 177.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.654 HD11 ' HB ' ' A' ' 6' ' ' THR . 39.9 mt -66.21 -65.17 0.71 Allowed 'General case' 0 CA--C 1.508 -0.653 0 C-N-CA 125.887 1.675 . . . . 0.0 109.137 -176.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.1 p -57.73 -32.96 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-O 117.846 -1.073 . . . . 0.0 108.519 175.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -67.48 -24.31 65.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 121.144 1.793 . . . . 0.0 111.32 178.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.68 -27.22 66.66 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.92 1.236 . . . . 0.0 110.302 175.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 89.4 t -85.73 -56.68 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 175.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.1 t -70.09 17.35 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 130.17 3.388 . . . . 0.0 112.278 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -57.49 -26.71 61.7 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 119.406 -2.059 . . . . 0.0 111.027 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -94.9 72.35 3.48 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 125.247 1.419 . . . . 0.0 107.521 176.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -143.79 176.21 9.42 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.521 0.728 . . . . 0.0 110.209 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.68 -66.15 0.94 Allowed 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.772 0.829 . . . . 0.0 111.549 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -155.49 176.27 12.81 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.376 2.27 . . . . 0.0 111.778 -175.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -122.95 163.86 19.59 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.975 0.91 . . . . 0.0 111.212 175.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -138.67 147.75 43.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 -175.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.5 t -118.27 123.32 71.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 3.0 mt -132.44 143.27 40.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -176.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 7.7 p -143.24 -0.59 1.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.566 1.146 . . . . 0.0 112.679 -176.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -139.24 157.03 46.63 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.053 1.741 . . . . 0.0 108.846 -175.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -73.54 -41.67 62.68 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.823 -176.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -62.55 -34.37 76.81 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 120.136 1.335 . . . . 0.0 109.429 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -65.48 -23.3 66.87 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.785 1.634 . . . . 0.0 110.768 175.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -86.44 -23.53 26.0 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.657 1.183 . . . . 0.0 113.888 -176.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -57.15 123.84 16.67 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.711 1.204 . . . . 0.0 110.753 -176.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -61.97 -23.82 66.63 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.529 ' HA ' ' CE ' ' A' ' 129' ' ' LYS 0.356 10.5 t70 -57.69 -52.16 66.59 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 121.454 1.934 . . . . 0.0 113.526 -175.437 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -74.35 -23.15 58.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 116.821 -1.952 . . . . 0.0 109.019 -177.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 56.6 mt -55.78 -41.8 67.43 Favored 'Isoleucine or valine' 0 C--N 1.347 0.473 0 CA-C-N 119.283 0.947 . . . . 0.0 108.519 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.529 ' CE ' ' HA ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -54.73 -51.23 66.29 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 119.91 1.232 . . . . 0.0 111.434 175.588 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.9 t -71.25 -31.39 67.48 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.058 -175.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 36.1 tp10 -63.93 -46.51 84.46 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.612 1.165 . . . . 0.0 108.798 175.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 91.2 mt -66.18 -31.01 71.59 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.555 -0.716 . . . . 0.0 110.412 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? -65.98 -49.13 68.92 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.488 1.04 . . . . 0.0 108.317 175.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 39.9 mtmt -56.46 -45.06 81.04 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.824 0.738 . . . . 0.0 110.117 176.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.6 1.63 3.03 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.358 1.463 . . . . 0.0 114.029 176.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -146.83 -103.94 0.37 Allowed Glycine 0 C--N 1.335 0.496 0 N-CA-C 108.413 -1.875 . . . . 0.0 108.413 176.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.28 173.96 43.46 Favored Glycine 0 CA--C 1.526 0.72 0 C-N-CA 123.969 0.795 . . . . 0.0 111.17 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -159.5 -178.11 6.89 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.557 2.343 . . . . 0.0 106.66 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -127.2 65.18 1.31 Allowed 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 175.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -145.29 112.78 6.23 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.095 -2.187 . . . . 0.0 105.095 -176.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -145.92 171.08 15.35 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 129.17 2.988 . . . . 0.0 103.297 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -148.24 136.24 21.05 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 121.349 1.886 . . . . 0.0 114.167 -175.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -83.31 25.78 0.7 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.493 1.917 . . . . 0.0 110.112 175.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 86.43 56.57 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 128.639 2.776 . . . . 0.0 106.012 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 . . . . . 0 C--O 1.249 1.029 0 C-N-CA 129.018 2.927 . . . . 0.0 105.427 -176.1 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.632 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.5 mp -143.22 145.09 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.27 125.17 38.33 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 175.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.96 151.31 44.07 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 118.71 0.686 . . . . 0.0 110.53 -176.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -101.51 64.1 0.99 Allowed 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.503 ' HB ' HD11 ' A' ' 103' ' ' LEU . 3.2 m -143.05 166.44 24.63 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 126.065 1.746 . . . . 0.0 106.805 -175.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.5 tttm -130.14 -178.66 4.83 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 124.137 0.975 . . . . 0.0 109.799 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.407 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -135.56 147.81 28.59 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 176.254 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -89.91 73.06 7.47 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 175.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -31.6 69.84 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-O 118.108 -0.949 . . . . 0.0 109.649 -176.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -63.74 -56.85 12.48 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.26 0.936 . . . . 0.0 109.394 -177.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.18 -43.27 82.6 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 122.27 -0.268 . . . . 0.0 110.846 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 79.9 m -68.91 -28.14 66.41 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.436 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -61.5 -38.86 88.86 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.527 176.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.44 -56.3 23.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 119.358 0.981 . . . . 0.0 109.771 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.412 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -61.06 -42.93 99.42 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.862 -0.524 . . . . 0.0 111.268 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -53.34 -48.48 68.45 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 175.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -61.56 -47.01 87.45 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 124.93 1.292 . . . . 0.0 110.348 -176.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -63.74 -27.39 69.17 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.422 ' CG2' HG23 ' A' ' 30' ' ' VAL . 6.6 t -83.53 -33.27 9.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 118.889 0.768 . . . . 0.0 109.948 175.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -70.56 -44.69 66.89 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.493 1.917 . . . . 0.0 111.743 178.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -70.83 123.49 22.1 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.646 1.578 . . . . 0.0 113.162 -175.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -72.21 -11.83 60.9 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.705 0.802 . . . . 0.0 110.217 175.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.74 -26.6 62.47 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 125.514 1.531 . . . . 0.0 111.705 175.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.2 t -85.92 150.24 24.64 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 125.915 1.686 . . . . 0.0 108.709 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.93 -14.58 44.3 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.215 0.606 . . . . 0.0 111.723 175.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.6 t -70.53 133.54 31.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -176.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -116.31 -24.06 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 118.456 -0.783 . . . . 0.0 111.44 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 55.0 p-90 -131.61 153.15 50.22 Favored 'General case' 0 C--N 1.341 0.196 0 CA-C-N 120.014 1.279 . . . . 0.0 110.83 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.422 HG23 ' CG2' ' A' ' 20' ' ' VAL . 4.7 t -140.86 164.37 21.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 129.663 3.185 . . . . 0.0 109.122 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 39.2 p -128.82 158.56 38.36 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.366 1.466 . . . . 0.0 107.883 175.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -133.56 123.69 25.58 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.5 mtpt -99.63 176.9 5.32 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 175.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -117.53 144.13 45.39 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 175.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -142.83 156.47 44.95 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 175.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 35.92 -104.7 0.03 OUTLIER Glycine 0 CA--C 1.53 0.992 0 C-N-CA 125.742 1.639 . . . . 0.0 112.065 -175.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.6 p -129.89 41.96 3.35 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 127.443 2.297 . . . . 0.0 109.456 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.9 t -149.55 172.73 14.54 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.113 0.965 . . . . 0.0 112.349 -175.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.5 mm -99.62 140.03 19.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 175.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.7 m -129.85 156.57 78.76 Favored Pre-proline 0 N--CA 1.469 0.514 0 C-N-CA 123.436 0.694 . . . . 0.0 110.551 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -71.46 154.35 60.57 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 121.812 1.674 . . . . 0.0 109.98 175.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -126.28 -158.21 9.82 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 125.738 1.637 . . . . 0.0 109.703 176.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -53.17 157.55 1.83 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 126.607 1.963 . . . . 0.0 111.468 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.2 pm0 -144.57 169.86 17.17 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.269 1.428 . . . . 0.0 109.885 177.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -172.61 166.47 39.16 Favored Glycine 0 CA--C 1.522 0.48 0 CA-C-O 122.222 0.901 . . . . 0.0 112.76 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -99.23 -18.51 17.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 125.239 1.416 . . . . 0.0 110.548 175.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 49' ' ' GLN . 4.9 tp10 -129.2 139.02 52.03 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 176.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.419 ' CE1' ' CD2' ' A' ' 51' ' ' PHE . 53.8 t80 -83.82 -5.18 59.15 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 126.633 1.973 . . . . 0.0 113.077 -175.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.42 ' H ' ' HG3' ' A' ' 47' ' ' GLU . 18.2 tt0 -57.72 -36.85 72.58 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 120.62 -1.3 . . . . 0.0 110.958 176.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -65.77 -39.9 91.49 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.943 0.897 . . . . 0.0 110.504 176.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.419 ' CD2' ' CE1' ' A' ' 48' ' ' TYR . 33.2 t80 -56.97 -34.94 68.57 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 125.223 1.409 . . . . 0.0 112.029 -176.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.1 mm -60.03 -35.75 63.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 -178.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 24.8 mm100 -85.86 -24.15 26.81 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.429 1.492 . . . . 0.0 112.457 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -67.48 -24.66 65.62 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 118.942 0.792 . . . . 0.0 111.467 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 78.0 m -75.21 113.42 12.54 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.311 2.1 p -92.89 171.23 9.1 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.595 1.558 . . . . 0.0 112.667 -175.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -47.21 -74.65 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 118.118 2.636 . . . . 0.0 118.118 -174.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -107.51 -35.62 6.7 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 127.323 2.249 . . . . 0.0 115.965 -174.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.4 m -54.93 155.53 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 N-CA-C 114.714 1.376 . . . . 0.0 114.714 -175.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 26.7 ptt-85 -103.99 135.32 45.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.6 tp -142.74 165.71 26.64 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 125.989 1.716 . . . . 0.0 107.249 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -131.41 154.55 48.53 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.488 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -136.45 151.97 50.07 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 123.581 0.752 . . . . 0.0 111.222 176.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -123.46 123.57 40.95 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 104.191 -2.522 . . . . 0.0 104.191 175.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.9 t -130.36 139.27 51.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 122.866 0.467 . . . . 0.0 109.879 -175.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -86.8 126.61 34.73 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 106.179 -1.785 . . . . 0.0 106.179 175.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -136.11 168.36 19.52 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -175.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m -127.13 114.22 17.43 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 120.717 -1.239 . . . . 0.0 108.066 175.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 m -144.17 147.39 33.61 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 175.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 105.78 118.57 4.45 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 125.274 1.416 . . . . 0.0 110.997 175.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -77.67 121.86 24.55 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 124.669 1.188 . . . . 0.0 108.068 -177.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.26 173.25 12.4 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 125.25 1.42 . . . . 0.0 108.836 175.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 93.7 mtp -73.35 3.63 5.67 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.809 0.843 . . . . 0.0 111.379 175.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.3 m -143.28 168.79 18.97 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 128.288 2.635 . . . . 0.0 106.821 176.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -67.13 165.45 15.92 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -133.31 153.96 51.12 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 105.667 -1.975 . . . . 0.0 105.667 175.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 t -129.59 123.93 32.53 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 176.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 49.5 mttt -132.49 145.54 51.25 Favored 'General case' 0 CA--C 1.503 -0.864 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -114.65 144.68 43.04 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.439 -0.8 . . . . 0.0 108.981 -175.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -116.24 121.22 41.4 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 -178.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -91.02 113.36 25.6 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 102.251 -3.24 . . . . 0.0 102.251 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -103.05 143.93 14.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -122.43 123.53 41.53 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 104.737 -2.32 . . . . 0.0 104.737 175.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.8 t-105 -100.78 124.03 45.83 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 104.033 -2.58 . . . . 0.0 104.033 175.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.2 mm -127.12 98.62 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.694 0 N-CA-C 102.155 -3.276 . . . . 0.0 102.155 175.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -44.22 126.85 6.38 Favored Glycine 0 C--N 1.342 0.867 0 N-CA-C 107.008 -2.437 . . . . 0.0 107.008 176.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -54.5 -7.64 0.17 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 -175.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -83.56 -35.87 24.41 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.755 1.622 . . . . 0.0 112.454 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.4 p -75.07 135.75 26.58 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 CA-C-N 121.029 1.74 . . . . 0.0 111.62 -175.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.0 t -146.4 176.7 9.59 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.821 1.248 . . . . 0.0 108.909 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 81.05 -142.58 23.37 Favored Glycine 0 CA--C 1.521 0.443 0 O-C-N 121.654 -0.654 . . . . 0.0 113.062 175.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 9.2 tt -53.18 -44.66 68.09 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 124.791 1.237 . . . . 0.0 110.578 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -60.83 -35.55 76.82 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.115 0.566 . . . . 0.0 110.953 -177.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.8 ttt-85 -70.7 -44.56 66.7 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.209 -0.932 . . . . 0.0 108.542 175.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.69 68.87 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.184 0.594 . . . . 0.0 112.444 177.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -58.62 -54.71 44.0 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 175.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.0 m -51.7 -45.67 63.59 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 119.513 1.051 . . . . 0.0 109.974 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -60.4 -25.88 63.43 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-O 119.91 -0.383 . . . . 0.0 113.729 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.8 m -101.4 -9.83 20.77 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.058 1.743 . . . . 0.0 111.232 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -103.84 -23.81 13.36 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 126.134 1.773 . . . . 0.0 112.462 -175.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 42.1 mtpt -54.25 -31.84 54.53 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.466 1.484 . . . . 0.0 112.035 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 5.4 t -66.84 -29.4 69.31 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.288 0.949 . . . . 0.0 112.226 175.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.503 HD11 ' HB ' ' A' ' 6' ' ' THR . 10.7 mt -68.21 -63.55 1.04 Allowed 'General case' 0 CA--C 1.509 -0.604 0 C-N-CA 125.169 1.388 . . . . 0.0 108.758 -176.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.36 -29.02 41.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 118.04 -0.981 . . . . 0.0 108.741 175.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.6 tttp -65.82 -27.34 68.18 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 120.87 1.668 . . . . 0.0 110.72 175.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -65.02 -27.51 68.86 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 121.224 1.829 . . . . 0.0 111.107 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 72.8 t -85.71 -48.87 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 175.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 65.6 t -84.46 26.07 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 128.796 2.838 . . . . 0.0 111.15 -175.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -56.93 -26.32 59.23 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 121.246 1.839 . . . . 0.0 110.942 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -90.08 80.66 6.3 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.954 1.702 . . . . 0.0 106.867 175.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -148.6 176.31 10.44 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 175.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.42 -64.69 1.26 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.899 0.88 . . . . 0.0 111.789 -175.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -132.03 172.32 12.51 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.353 1.461 . . . . 0.0 110.366 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -125.89 164.54 20.52 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.757 1.223 . . . . 0.0 108.234 175.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -150.96 146.07 26.01 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 103.831 -2.655 . . . . 0.0 103.831 -175.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.7 t -122.98 123.82 68.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 3.3 mt -129.41 150.82 34.99 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 125.459 1.504 . . . . 0.0 108.76 -175.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.0 p -151.27 0.34 0.38 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.34 1.056 . . . . 0.0 113.804 177.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.455 ' OD1' ' HE2' ' A' ' 121' ' ' LYS . 5.0 t70 -126.03 145.87 50.13 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.15 1.38 . . . . 0.0 108.906 -175.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 45.4 ttt85 -65.46 -33.93 77.08 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.455 ' HE2' ' OD1' ' A' ' 119' ' ' ASP . 7.4 mtmm -68.78 -45.64 70.8 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 120.125 1.33 . . . . 0.0 108.169 175.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.02 -23.77 62.25 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.466 1.907 . . . . 0.0 111.596 -179.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -78.16 -22.85 48.09 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.571 1.948 . . . . 0.0 113.782 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -69.99 129.84 40.57 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.562 1.528 . . . . 0.0 113.592 -176.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -57.92 -25.79 61.35 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.082 1.353 . . . . 0.0 113.715 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -53.61 -55.04 29.24 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 123.869 0.868 . . . . 0.0 112.495 -176.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -86.37 -23.86 26.02 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 118.517 -1.273 . . . . 0.0 109.029 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 64.4 mt -55.06 -40.13 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 175.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 65.6 mttt -52.14 -54.27 32.66 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.977 0.808 . . . . 0.0 110.012 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.4 ' HA ' ' HE3' ' A' ' 133' ' ' LYS . 4.2 t -69.0 -36.03 77.36 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.957 -0.544 . . . . 0.0 111.27 -177.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -64.3 -39.46 93.97 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.991 1.269 . . . . 0.0 110.054 176.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 67.5 mt -69.78 -30.52 68.1 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 120.94 -1.1 . . . . 0.0 110.1 175.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 130' ' ' SER . 8.0 mtmp? -67.25 -45.94 75.22 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 175.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -57.21 -55.78 30.27 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.0 -25.98 46.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.407 1.083 . . . . 0.0 111.811 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -76.42 83.08 1.01 Allowed Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 175.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 117.91 -18.87 11.37 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 125.729 1.633 . . . . 0.0 112.837 177.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.86 99.83 1.1 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.415 1.108 . . . . 0.0 110.629 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -124.55 110.02 13.95 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -134.77 97.33 3.74 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -147.12 81.81 1.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -141.35 136.56 31.6 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 124.107 0.963 . . . . 0.0 110.772 -175.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -133.43 148.2 51.76 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 124.525 1.13 . . . . 0.0 109.135 176.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.0 m 59.01 23.49 11.63 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.036 1.734 . . . . 0.0 110.598 177.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 . . . . . 0 C--O 1.256 1.417 0 C-N-CA 128.284 2.634 . . . . 0.0 107.624 -177.983 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.707 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.8 tp -153.45 113.37 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 117.994 0.897 . . . . 0.0 108.712 175.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -83.67 113.97 21.24 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -177.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 9.5 ptm -149.77 175.5 11.54 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.141 0.577 . . . . 0.0 110.491 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -147.87 65.84 1.11 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.75 1.22 . . . . 0.0 109.47 175.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.603 ' HB ' HD11 ' A' ' 103' ' ' LEU . 5.0 m -121.99 176.1 5.97 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.215 1.806 . . . . 0.0 106.575 178.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -137.86 -179.22 5.64 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.733 -1.23 . . . . 0.0 113.584 -175.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -131.23 148.6 32.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 C-N-CA 124.522 1.129 . . . . 0.0 108.891 175.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -94.43 76.73 3.88 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 102.455 -3.165 . . . . 0.0 102.455 175.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.6 ttpt -60.26 -27.22 67.06 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 118.047 -0.978 . . . . 0.0 112.812 -175.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -69.35 -57.96 4.62 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 119.588 1.085 . . . . 0.0 109.927 176.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.96 -40.58 83.18 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.758 0.708 . . . . 0.0 110.982 -178.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.6 m -67.68 -29.84 69.21 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 121.369 -0.832 . . . . 0.0 111.4 -178.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.7 ttt85 -60.65 -33.18 72.43 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-O 117.418 -1.277 . . . . 0.0 109.508 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.63 -51.48 69.23 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 120.126 1.33 . . . . 0.0 110.118 -179.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.515 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -60.49 -49.71 76.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 121.913 -0.492 . . . . 0.0 110.835 178.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -56.27 -38.92 71.82 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.051 0.54 . . . . 0.0 111.196 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -62.93 -55.88 22.04 Favored 'General case' 0 CA--C 1.522 -0.126 0 C-N-CA 124.854 1.262 . . . . 0.0 110.046 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mp -59.84 -32.17 70.43 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 81.6 t -75.62 -34.55 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-N 118.487 0.585 . . . . 0.0 109.528 176.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -72.33 -42.72 65.07 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 119.271 0.942 . . . . 0.0 111.239 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.64 136.64 57.19 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 126.408 1.883 . . . . 0.0 114.022 -175.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.412 ' CG ' HH22 ' A' ' 66' ' ' ARG . 0.8 OUTLIER -86.27 -21.91 27.1 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.539 1.536 . . . . 0.0 113.049 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.24 -33.07 36.86 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 108.789 -1.725 . . . . 0.0 108.789 175.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 t -66.4 123.72 20.77 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 175.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -78.04 -6.76 55.58 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.144 0.578 . . . . 0.0 111.442 175.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.6 t -70.17 127.42 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 175.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.04 -23.82 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 CA-C-O 118.376 -0.821 . . . . 0.0 109.716 175.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 38.6 p-90 -130.71 140.46 50.35 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.737 1.153 . . . . 0.0 110.701 178.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.515 HG11 ' HB1' ' A' ' 16' ' ' ALA . 35.0 t -139.59 152.3 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 175.244 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 37.2 p -103.56 158.8 16.11 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -127.91 123.97 36.24 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -110.63 176.33 5.08 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 104.967 -2.234 . . . . 0.0 104.967 -176.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -119.54 140.66 50.17 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 177.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -141.01 136.02 31.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 55.59 -96.35 0.04 OUTLIER Glycine 0 CA--C 1.531 1.045 0 CA-C-N 119.001 0.819 . . . . 0.0 111.654 -178.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.2 p -136.26 28.74 3.08 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.31 1.844 . . . . 0.0 111.333 175.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.8 t -143.92 163.66 32.81 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 -175.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 34.2 mm -83.67 138.94 18.39 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 105.705 -1.961 . . . . 0.0 105.705 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.0 m -134.26 159.43 72.33 Favored Pre-proline 0 C--N 1.329 -0.309 0 C-N-CA 124.765 1.226 . . . . 0.0 109.534 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.42 162.08 36.57 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 CA-C-N 120.801 1.322 . . . . 0.0 108.887 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -127.61 -165.0 11.78 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 126.263 1.887 . . . . 0.0 109.832 175.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -56.06 159.27 3.43 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.723 1.209 . . . . 0.0 110.914 177.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -145.2 168.21 20.94 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.184 1.394 . . . . 0.0 111.843 -175.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.1 -174.62 43.69 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 122.23 0.906 . . . . 0.0 112.328 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.41 -21.06 7.61 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.998 1.719 . . . . 0.0 110.992 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -106.24 117.36 33.83 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.571 1.148 . . . . 0.0 108.695 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -82.79 -16.09 49.17 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.24 0.616 . . . . 0.0 110.151 -177.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -62.57 -27.28 69.07 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 119.545 -1.972 . . . . 0.0 109.964 175.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -76.07 -31.4 58.75 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.74 1.216 . . . . 0.0 111.05 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -57.51 -35.97 70.94 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 125.009 1.323 . . . . 0.0 110.383 178.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.7 mm -58.58 -33.68 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 -176.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -77.78 -24.02 49.0 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.485 1.114 . . . . 0.0 112.213 177.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -72.3 -24.09 61.27 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 119.804 1.184 . . . . 0.0 112.091 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.5 m -65.97 132.97 49.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.772 0.715 . . . . 0.0 109.763 -177.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.256 2.1 p -112.95 163.5 14.59 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.696 1.998 . . . . 0.0 110.622 -176.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -50.05 -76.38 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 130.224 3.41 . . . . 0.0 117.314 -175.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -102.67 -36.09 8.45 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 123.669 0.788 . . . . 0.0 112.667 -175.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.4 m -56.73 147.98 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 CA-C-O 122.264 1.03 . . . . 0.0 112.078 -175.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.443 ' NE ' ' H ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -103.58 136.42 43.34 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.454 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 41.4 tp -138.19 167.81 21.05 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.918 1.287 . . . . 0.0 108.088 -176.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -132.39 146.97 52.35 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -144.45 124.49 13.59 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 118.39 0.541 . . . . 0.0 109.87 175.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.427 ' CE1' HG13 ' A' ' 108' ' ' VAL . 26.6 t80 -90.31 123.67 34.27 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 175.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.3 t -133.96 140.86 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 121.397 0.617 . . . . 0.0 109.764 -175.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.412 HH22 ' CG ' ' A' ' 23' ' ' ASP . 48.7 ttt180 -84.73 139.0 32.3 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.37 1.468 . . . . 0.0 108.667 175.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -136.2 150.24 48.91 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.159 1.384 . . . . 0.0 108.508 -176.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 99.3 m -96.95 113.46 25.0 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.0 m -156.76 153.66 28.73 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 121.004 -1.06 . . . . 0.0 110.289 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 117.18 167.73 14.5 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 126.461 1.981 . . . . 0.0 111.808 175.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -134.77 116.88 15.36 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.634 0.774 . . . . 0.0 111.097 -175.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.655 ' HB2' ' HE ' ' A' ' 76' ' ' ARG . . . -146.82 176.72 9.67 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 127.293 2.237 . . . . 0.0 105.788 174.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 25.5 mmt -70.6 6.68 1.33 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.608 0.763 . . . . 0.0 111.137 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.3 m -146.43 173.7 12.05 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.337 2.255 . . . . 0.0 108.84 175.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -63.3 163.59 10.28 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.852 0.834 . . . . 0.0 109.662 175.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.655 ' HE ' ' HB2' ' A' ' 72' ' ' ALA . 8.4 mmt85 -128.29 167.72 16.52 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 126.25 1.82 . . . . 0.0 108.096 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.3 t -133.24 142.48 48.56 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.0 mmtp -141.5 172.15 13.08 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 125.939 1.696 . . . . 0.0 108.002 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -145.55 130.03 17.85 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 -177.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.83 119.02 33.61 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.69 113.24 21.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 103.295 -2.854 . . . . 0.0 103.295 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.4 mp -85.28 132.89 30.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 176.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -116.46 123.28 47.11 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 101.873 -3.38 . . . . 0.0 101.873 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.1 t-105 -102.29 126.87 49.41 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 106.325 -1.732 . . . . 0.0 106.325 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.4 HG21 ' HG3' ' A' ' 94' ' ' ARG . 8.5 mt -138.48 102.0 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 N-CA-C 104.471 -2.418 . . . . 0.0 104.471 175.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.91 125.13 37.87 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 105.992 -2.843 . . . . 0.0 105.992 175.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -55.68 -3.88 0.09 Allowed 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 119.95 1.875 . . . . 0.0 115.003 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 -82.97 -31.35 27.64 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 120.596 -1.315 . . . . 0.0 109.723 177.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 13.9 p -69.58 136.66 25.75 Favored 'Isoleucine or valine' 0 C--N 1.343 0.31 0 CA-C-N 120.306 1.412 . . . . 0.0 109.588 176.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.3 t -144.04 177.01 8.87 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.306 1.442 . . . . 0.0 108.702 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.02 -145.3 49.63 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 176.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.68 -42.32 78.84 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 124.557 1.143 . . . . 0.0 110.901 -176.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -59.83 -43.42 94.57 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 119.215 0.916 . . . . 0.0 110.06 -176.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.4 ' HG3' HG21 ' A' ' 85' ' ' ILE . 12.5 ttp180 -69.64 -44.21 71.07 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.425 -0.797 . . . . 0.0 109.069 175.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.58 -23.47 50.95 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.144 0.978 . . . . 0.0 112.548 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -51.24 -53.82 31.68 Favored 'General case' 0 CA--C 1.504 -0.808 0 CA-C-N 119.772 1.169 . . . . 0.0 108.356 175.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.3 m -57.05 -41.04 77.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.737 0.699 . . . . 0.0 111.558 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.78 -18.78 64.51 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-N 118.161 0.437 . . . . 0.0 112.843 176.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.6 m -103.41 -17.74 15.12 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.416 1.086 . . . . 0.0 111.677 176.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -103.05 -23.99 13.65 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 117.755 2.502 . . . . 0.0 117.755 -174.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.2 mtmt -50.12 -28.01 6.61 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 122.212 2.278 . . . . 0.0 114.089 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.5 t -62.92 -35.5 80.3 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.119 1.327 . . . . 0.0 111.657 176.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.603 HD11 ' HB ' ' A' ' 6' ' ' THR . 22.6 mt -61.73 -64.54 0.91 Allowed 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 126.554 1.942 . . . . 0.0 109.054 -176.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.409 HG12 ' H ' ' A' ' 104' ' ' VAL . 0.9 OUTLIER -56.92 -32.73 40.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.343 175.87 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -26.34 64.89 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 120.748 1.613 . . . . 0.0 111.793 175.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -64.38 -28.19 69.53 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 120.719 -1.238 . . . . 0.0 110.165 175.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 95.5 t -86.6 -65.59 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 125.338 1.455 . . . . 0.0 108.294 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.427 HG13 ' CE1' ' A' ' 64' ' ' PHE . 19.9 t -67.58 27.4 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.882 1 C-N-CA 132.97 4.508 . . . . 0.0 113.464 -175.687 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -52.63 -26.15 12.81 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.184 -1.573 . . . . 0.0 114.309 -175.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -104.83 95.22 5.73 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -150.66 163.33 38.78 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.298 1.039 . . . . 0.0 108.95 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.81 -66.69 0.58 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.83 163.46 5.01 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 131.493 3.917 . . . . 0.0 105.836 175.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -85.6 173.16 10.36 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 122.521 0.328 . . . . 0.0 111.018 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -129.59 157.45 42.05 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.5 t -116.95 123.81 72.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 175.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mt -132.06 126.71 56.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . 0.382 2.8 p -126.6 1.22 6.85 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 115.848 1.796 . . . . 0.0 115.848 175.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -146.17 158.03 43.86 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.802 0.841 . . . . 0.0 110.358 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -55.49 -42.25 74.14 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.836 175.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.42 -27.56 67.58 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 120.561 1.528 . . . . 0.0 112.612 178.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -83.37 -23.97 32.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.518 1.127 . . . . 0.0 110.751 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -75.56 -23.79 56.59 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.014 2.126 . . . . 0.0 113.091 -178.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -68.8 123.18 20.24 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -175.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.417 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 4.0 mm-40 -50.69 -32.12 18.41 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 115.973 1.842 . . . . 0.0 115.973 175.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -56.3 -32.31 64.48 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 115.478 1.658 . . . . 0.0 115.478 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.6 p90 -108.03 -21.54 12.77 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.45 1.023 . . . . 0.0 108.589 175.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.417 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 46.8 mt -56.15 -36.97 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 175.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -58.73 -53.67 55.71 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.771 -0.581 . . . . 0.0 110.345 176.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 9.1 t -64.65 -31.79 73.17 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.135 0.879 . . . . 0.0 111.89 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -65.29 -52.89 51.19 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 124.997 1.319 . . . . 0.0 109.146 176.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 47.3 mt -60.88 -34.72 75.05 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.499 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -62.13 -52.98 61.67 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.194 0.906 . . . . 0.0 108.846 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 26.5 mmtt -54.28 -52.58 60.99 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.413 0.685 . . . . 0.0 110.928 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.48 -26.24 66.27 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.49 122.62 10.92 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 124.163 0.887 . . . . 0.0 112.264 -175.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -139.22 169.01 24.67 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 125.341 1.448 . . . . 0.0 109.571 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.87 122.16 10.21 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 125.028 1.331 . . . . 0.0 111.372 -176.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -153.34 110.14 3.42 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 105.424 -2.065 . . . . 0.0 105.424 175.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -136.52 71.49 1.42 Allowed 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 122.702 1.239 . . . . 0.0 107.669 176.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -69.58 114.71 8.05 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 113.553 -1.658 . . . . 0.0 108.388 -176.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -73.99 112.91 10.57 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -133.08 143.03 49.06 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.382 1.073 . . . . 0.0 108.442 -175.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 62.53 50.0 3.77 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.732 1.213 . . . . 0.0 110.73 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 125.448 1.499 . . . . 0.0 107.569 175.6 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.805 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -142.14 173.28 7.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 127.218 2.207 . . . . 0.0 107.757 176.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -63.73 127.99 33.81 Favored 'General case' 0 CA--C 1.521 -0.146 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.97 175.9 9.25 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.685 0.794 . . . . 0.0 111.214 178.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -133.8 56.35 1.85 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.032 1.333 . . . . 0.0 110.706 -179.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.573 ' HB ' HD11 ' A' ' 103' ' ' LEU . 3.4 m -110.38 170.74 7.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.335 1.854 . . . . 0.0 106.07 175.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -125.09 172.71 9.25 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.778 -1.201 . . . . 0.0 110.819 -176.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.419 ' HA ' ' H ' ' A' ' 39' ' ' ILE . 0.1 OUTLIER -142.68 153.4 17.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 C-N-CA 124.582 1.153 . . . . 0.0 109.29 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -94.6 73.37 3.71 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 102.69 -3.078 . . . . 0.0 102.69 175.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 31.4 pttt -58.88 -27.84 65.57 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 117.454 -1.26 . . . . 0.0 111.448 -175.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.2 -56.39 5.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.191 0.997 . . . . 0.0 110.068 -175.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.78 -35.45 77.07 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 121.2 -0.2 . . . . 0.0 110.684 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.0 m -69.46 -34.21 74.05 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 118.534 -0.746 . . . . 0.0 110.363 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 76.0 ttt-85 -60.09 -39.63 86.82 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.846 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.62 -59.0 5.31 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 123.878 0.737 . . . . 0.0 109.489 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.41 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -64.14 -36.7 84.89 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.873 -0.517 . . . . 0.0 112.121 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.417 ' CE1' ' HA ' ' A' ' 108' ' ' VAL . 17.7 t80 -62.2 -28.77 69.91 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.181 0.992 . . . . 0.0 111.207 175.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -74.89 -46.37 36.49 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 124.264 1.025 . . . . 0.0 109.376 175.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.5 mp -57.13 -56.39 22.35 Favored 'General case' 0 C--O 1.221 -0.396 0 O-C-N 121.586 -0.696 . . . . 0.0 110.627 175.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.9 t -59.45 -29.08 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 118.494 0.588 . . . . 0.0 111.13 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -69.94 -45.43 67.49 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 119.992 1.269 . . . . 0.0 111.224 175.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -63.36 123.65 19.25 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.994 1.718 . . . . 0.0 111.311 -175.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -64.81 -27.85 69.16 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.975 1.31 . . . . 0.0 111.992 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.15 -11.31 76.27 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 124.4 1.0 . . . . 0.0 112.669 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -62.08 128.75 37.63 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 119.046 1.423 . . . . 0.0 108.461 176.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.26 -35.78 82.1 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.8 t -72.5 126.26 32.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 125.42 1.488 . . . . 0.0 108.23 175.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.3 pp -113.72 -23.68 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 124.967 1.307 . . . . 0.0 111.062 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -128.08 145.63 50.94 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.784 0.72 . . . . 0.0 109.975 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.41 HG21 ' HB1' ' A' ' 16' ' ' ALA . 9.5 t -135.83 161.82 37.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 126.482 1.913 . . . . 0.0 107.636 176.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.447 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 14.2 p -119.54 159.26 24.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.377 1.071 . . . . 0.0 108.939 175.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -137.09 127.8 27.11 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.378 1.471 . . . . 0.0 107.254 -177.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -113.74 176.75 4.9 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 127.074 2.15 . . . . 0.0 107.805 -178.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -118.91 138.22 52.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 175.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -137.48 132.43 33.3 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 59.12 -107.43 1.2 Allowed Glycine 0 CA--C 1.529 0.945 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -175.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.1 p -130.09 29.84 4.87 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.899 1.279 . . . . 0.0 111.704 175.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -130.37 169.1 15.91 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.635 0.652 . . . . 0.0 110.215 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.419 ' H ' ' HA ' ' A' ' 8' ' ' ILE . 38.5 mm -94.98 138.33 21.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 104.21 -2.515 . . . . 0.0 104.21 175.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.3 m -130.81 154.32 81.86 Favored Pre-proline 0 C--N 1.329 -0.309 0 C-N-CA 124.067 0.947 . . . . 0.0 110.326 176.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -75.81 159.66 38.21 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 C-N-CA 121.986 1.791 . . . . 0.0 109.386 175.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -130.62 -162.77 10.8 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 127.201 2.334 . . . . 0.0 108.965 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -58.93 166.92 1.78 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 126.2 1.8 . . . . 0.0 111.723 -176.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.74 171.31 16.44 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 124.749 1.219 . . . . 0.0 111.127 -175.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -171.97 -178.06 41.98 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 123.763 0.697 . . . . 0.0 111.891 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.3 -26.69 7.08 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.871 1.268 . . . . 0.0 111.378 176.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -105.81 130.26 53.82 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 105.672 -1.973 . . . . 0.0 105.672 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.419 ' CE2' ' CD2' ' A' ' 51' ' ' PHE . 21.6 t80 -82.84 -9.47 59.31 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.511 0.724 . . . . 0.0 110.413 -175.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -54.22 -33.73 59.0 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.329 -1.482 . . . . 0.0 110.607 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.4 m80 -68.27 -25.04 64.97 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.305 1.442 . . . . 0.0 112.772 176.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.419 ' CD2' ' CE2' ' A' ' 48' ' ' TYR . 0.6 OUTLIER -62.84 -52.41 63.24 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.158 -0.964 . . . . 0.0 108.842 178.393 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.41 -40.31 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -178.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -61.23 -32.81 72.59 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.172 0.989 . . . . 0.0 112.362 175.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -81.27 -23.59 37.86 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 117.857 -1.068 . . . . 0.0 113.563 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 92.4 m -53.62 114.35 1.5 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 120.183 1.356 . . . . 0.0 111.756 -175.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.25 2.0 p -83.91 164.8 19.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.91 2.084 . . . . 0.0 112.153 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -55.34 -77.12 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 131.153 3.781 . . . . 0.0 120.645 -175.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -106.56 -20.79 13.26 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 127.042 2.137 . . . . 0.0 114.673 -174.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.0 m -68.11 168.67 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-O 122.484 1.135 . . . . 0.0 113.388 -175.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.75 123.37 42.51 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 103.109 -2.923 . . . . 0.0 103.109 175.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 42.7 tp -130.65 168.12 17.66 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.864 2.066 . . . . 0.0 109.072 -175.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -132.5 155.45 48.55 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 123.547 0.739 . . . . 0.0 109.679 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -146.23 137.25 24.41 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.272 0.629 . . . . 0.0 110.86 176.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -104.91 123.83 48.42 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 105.864 -1.902 . . . . 0.0 105.864 175.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.7 t -133.11 136.52 55.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 -175.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.3 ttp-105 -80.83 134.44 35.78 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -136.1 159.75 40.75 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.835 0.854 . . . . 0.0 108.97 -175.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.7 m -111.04 113.42 25.95 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 120.612 -1.305 . . . . 0.0 109.137 -177.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 14.6 m -155.99 163.6 39.51 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 175.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 91.79 157.21 33.46 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 108.248 -1.941 . . . . 0.0 108.248 -175.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -138.5 133.42 32.65 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.171 0.588 . . . . 0.0 109.754 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -145.98 -174.01 4.31 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 127.64 2.376 . . . . 0.0 108.113 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 63.1 mtm -76.46 -6.35 51.38 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.266 -0.896 . . . . 0.0 111.228 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.0 m -126.06 164.23 21.31 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 127.224 2.21 . . . . 0.0 107.49 175.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -62.99 157.47 21.81 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -122.15 162.66 20.9 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 -176.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.2 t -138.87 142.13 38.6 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 106.255 -1.757 . . . . 0.0 106.255 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -143.8 173.97 11.22 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 127.271 2.228 . . . . 0.0 106.525 -176.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -146.35 139.04 25.37 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.83 121.39 43.85 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 175.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.96 113.35 25.59 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 101.52 -3.511 . . . . 0.0 101.52 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mp -94.31 144.37 9.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 -178.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -124.05 123.45 40.38 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 103.186 -2.894 . . . . 0.0 103.186 175.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -100.11 128.63 46.16 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 105.129 -2.174 . . . . 0.0 105.129 175.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.0 mt -131.84 103.64 7.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 102.723 -3.065 . . . . 0.0 102.723 175.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -55.42 122.84 28.03 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 106.8 -2.52 . . . . 0.0 106.8 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -55.0 -3.61 0.05 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.561 1.544 . . . . 0.0 114.154 -175.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -83.53 -23.84 31.89 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.692 1.597 . . . . 0.0 110.343 179.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 11.9 p -85.87 144.98 8.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-N 120.714 1.597 . . . . 0.0 108.884 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.6 t -146.3 176.56 9.67 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 126.21 1.804 . . . . 0.0 107.41 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 61.04 -146.9 47.55 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 123.312 0.482 . . . . 0.0 113.54 176.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.3 tt -47.11 -51.39 18.0 Favored 'General case' 0 C--N 1.335 -0.029 0 C-N-CA 126.079 1.752 . . . . 0.0 113.504 -175.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.45 -38.36 86.91 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 120.277 1.399 . . . . 0.0 111.174 -178.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.2 ttt180 -65.78 -47.65 74.46 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 175.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.83 -27.02 66.27 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.613 1.165 . . . . 0.0 112.991 179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -50.82 -42.53 58.4 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 120.34 1.427 . . . . 0.0 110.281 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.7 m -54.62 -35.6 63.59 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 124.783 1.233 . . . . 0.0 110.256 -177.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.93 -26.33 74.48 Favored Glycine 0 CA--C 1.526 0.77 0 O-C-N 121.499 -0.75 . . . . 0.0 112.817 179.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.8 m -95.39 -8.69 34.9 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.545 1.538 . . . . 0.0 111.016 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -104.22 -29.66 10.68 Favored 'General case' 0 CA--C 1.514 -0.417 0 O-C-N 121.044 -1.035 . . . . 0.0 111.771 -175.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.1 mtpt -52.82 -35.24 56.79 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 118.932 0.787 . . . . 0.0 110.686 176.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.8 t -62.91 -37.64 87.77 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.73 0.695 . . . . 0.0 111.947 176.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.573 HD11 ' HB ' ' A' ' 6' ' ' THR . 7.0 mt -63.43 -60.02 3.92 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 124.388 1.075 . . . . 0.0 109.665 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.85 -30.96 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 117.726 -1.131 . . . . 0.0 109.886 176.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.66 -46.47 88.93 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 120.337 1.426 . . . . 0.0 109.887 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -56.32 -25.07 47.59 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 77.8 t -85.29 -62.51 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.417 ' HA ' ' CE1' ' A' ' 17' ' ' TYR . 21.2 t -68.77 27.25 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.887 1 C-N-CA 131.864 4.065 . . . . 0.0 113.706 -175.454 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -54.12 -26.55 28.03 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 119.789 -1.819 . . . . 0.0 115.098 -175.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -94.87 81.38 3.76 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 175.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -142.04 170.79 15.05 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 125.406 1.482 . . . . 0.0 108.752 176.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -87.55 -66.58 0.9 Allowed 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.71 176.24 12.62 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 128.856 2.863 . . . . 0.0 106.26 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.46 169.39 9.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.827 175.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -141.04 149.57 41.85 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 103.927 -2.62 . . . . 0.0 103.927 -175.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 48.4 t -121.94 128.67 75.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 106.555 -1.646 . . . . 0.0 106.555 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.7 mt -133.38 148.78 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 125.632 1.573 . . . . 0.0 107.976 -176.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 79.4 p -145.19 1.69 0.97 Allowed 'General case' 0 C--O 1.235 0.29 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 179.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -127.2 136.45 52.05 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 125.612 1.565 . . . . 0.0 107.387 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.43 -50.49 40.51 Favored 'General case' 0 CA--C 1.517 -0.302 0 C-N-CA 123.945 0.898 . . . . 0.0 110.683 177.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.27 -33.92 76.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 118.01 0.368 . . . . 0.0 110.504 -175.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -67.51 -23.32 65.45 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.937 1.295 . . . . 0.0 110.781 175.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -85.1 -23.91 28.28 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 125.315 1.446 . . . . 0.0 112.728 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -58.45 123.81 17.46 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.21 0.914 . . . . 0.0 109.671 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.552 ' HB3' ' HE3' ' A' ' 129' ' ' LYS . 27.5 mt-10 -65.35 -19.54 66.0 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 121.35 -0.844 . . . . 0.0 113.274 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -51.98 -51.43 57.31 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.139 0.881 . . . . 0.0 112.779 -175.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -85.62 -24.31 27.18 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.045 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 41.9 mt -56.92 -38.59 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 119.783 1.174 . . . . 0.0 108.376 175.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.552 ' HE3' ' HB3' ' A' ' 125' ' ' GLU . 41.4 mttt -52.94 -50.64 63.63 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 123.196 0.598 . . . . 0.0 109.783 176.179 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.5 t -66.0 -35.31 80.21 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.184 1.394 . . . . 0.0 112.064 176.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -63.7 -47.88 79.37 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.285 0.948 . . . . 0.0 109.201 176.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.77 -34.34 77.03 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.976 0.91 . . . . 0.0 109.88 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -65.57 -42.89 91.28 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.103 0.865 . . . . 0.0 109.274 175.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? -61.72 -52.83 62.64 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.641 0.776 . . . . 0.0 109.756 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -76.03 20.23 0.2 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.202 1.001 . . . . 0.0 112.499 176.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -71.39 178.85 34.03 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 124.228 0.918 . . . . 0.0 111.443 -176.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 93.33 119.93 2.92 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -176.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -163.68 169.03 19.07 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 126.828 2.051 . . . . 0.0 107.981 175.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -153.54 105.5 2.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 175.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -143.22 104.61 4.3 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 102.841 -3.022 . . . . 0.0 102.841 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.3 t0 -63.68 143.94 57.43 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 123.751 0.82 . . . . 0.0 110.647 -175.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -85.44 100.93 12.2 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 103.611 -2.737 . . . . 0.0 103.611 175.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -104.95 159.59 15.69 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 -176.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 64.06 38.64 8.36 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.855 1.262 . . . . 0.0 109.688 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 117.713 -1.137 . . . . 0.0 110.436 175.939 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.835 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.6 mp -114.58 -83.45 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.5 ptt-85 -143.8 164.12 31.4 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.594 1.558 . . . . 0.0 108.507 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 7.5 tpt -156.09 165.06 37.55 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.228 0.922 . . . . 0.0 108.786 175.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -76.01 59.1 1.26 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.831 1.252 . . . . 0.0 111.406 176.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.2 m -134.72 168.78 18.39 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 127.239 2.215 . . . . 0.0 105.797 176.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 45.4 tttm -138.51 172.54 12.73 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 120.642 -1.286 . . . . 0.0 108.836 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.431 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -122.84 149.52 26.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.004 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -83.23 85.03 7.28 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 103.432 -2.803 . . . . 0.0 103.432 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -62.54 -23.72 67.13 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.484 -1.246 . . . . 0.0 113.119 -175.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -79.13 -57.5 3.7 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 119.874 1.215 . . . . 0.0 108.112 179.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.17 -35.61 81.36 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.714 -176.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 82.9 m -80.04 -32.77 39.47 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 119.054 0.843 . . . . 0.0 111.037 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.7 ttt-85 -66.78 -26.86 67.17 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 117.328 -1.32 . . . . 0.0 109.713 175.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.89 -62.46 1.65 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 120.44 1.473 . . . . 0.0 109.441 176.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.428 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -54.79 -47.59 73.8 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.289 0.636 . . . . 0.0 111.431 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -52.15 -46.92 65.61 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 122.44 0.296 . . . . 0.0 110.965 175.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -64.41 -40.74 96.36 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.1 -0.953 . . . . 0.0 111.35 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.7 mp -60.4 -61.38 2.64 Favored 'General case' 0 C--O 1.221 -0.419 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 175.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.1 t -58.15 -32.96 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 122.806 0.442 . . . . 0.0 111.914 -175.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.85 -26.35 63.23 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 119.234 0.925 . . . . 0.0 110.9 176.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -76.02 127.41 32.9 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 118.986 0.812 . . . . 0.0 110.201 -177.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -61.37 -28.18 69.05 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.808 -0.557 . . . . 0.0 111.113 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.78 1.37 78.82 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.578 1.085 . . . . 0.0 113.627 178.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.8 t -85.98 124.9 32.95 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 120.627 2.213 . . . . 0.0 107.856 175.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.4 -33.12 71.01 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.9 t -64.73 131.01 30.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 C-N-CA 125.067 1.347 . . . . 0.0 107.389 175.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.3 pp -114.19 -23.62 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.448 1.499 . . . . 0.0 111.037 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.1 p-90 -131.74 146.89 52.41 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 118.814 0.733 . . . . 0.0 111.201 178.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.428 HG11 ' HB1' ' A' ' 16' ' ' ALA . 39.9 t -141.46 150.25 19.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 175.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.415 HG22 ' HB2' ' A' ' 63' ' ' ALA . 38.8 p -103.62 161.74 13.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -130.79 137.96 49.69 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 105.886 -1.894 . . . . 0.0 105.886 175.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -125.61 177.04 6.46 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 126.664 1.985 . . . . 0.0 107.396 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -118.52 137.28 53.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -133.96 123.83 25.3 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 175.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 58.3 -80.81 0.01 OUTLIER Glycine 0 CA--C 1.529 0.925 0 C-N-CA 126.005 1.764 . . . . 0.0 113.896 176.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.53 10.03 3.71 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.747 2.419 . . . . 0.0 113.664 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -149.82 173.24 13.97 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 120.266 1.394 . . . . 0.0 113.047 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 18.6 mm -84.28 140.03 16.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 175.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 10.4 m -131.17 160.52 66.63 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 125.482 1.513 . . . . 0.0 110.781 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.55 156.53 36.21 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.497 2.131 . . . . 0.0 109.94 175.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -126.46 -166.83 12.3 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 126.141 1.829 . . . . 0.0 109.532 175.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -54.05 161.67 1.18 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 117.948 0.874 . . . . 0.0 112.891 175.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.8 pm0 -141.79 164.71 29.46 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 127.582 2.353 . . . . 0.0 110.653 -175.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -167.03 172.73 42.2 Favored Glycine 0 CA--C 1.525 0.675 0 CA-C-O 121.837 0.687 . . . . 0.0 111.652 176.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -111.93 -2.7 15.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.647 1.179 . . . . 0.0 112.663 -176.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -139.47 150.41 45.14 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -83.6 -9.85 58.64 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.755 0.707 . . . . 0.0 111.875 -175.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -58.49 -39.57 80.38 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 120.597 -1.314 . . . . 0.0 110.252 175.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -76.21 -14.41 60.15 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.986 1.315 . . . . 0.0 112.781 176.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -72.84 -36.8 67.54 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 123.552 0.741 . . . . 0.0 110.147 175.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.7 mm -55.76 -44.97 79.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.31 0.644 . . . . 0.0 109.841 -175.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -61.72 -23.56 66.22 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.358 1.063 . . . . 0.0 113.495 177.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -70.99 -30.92 67.31 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.628 1.104 . . . . 0.0 112.1 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 56.7 m -72.25 113.58 9.44 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 105.513 -2.032 . . . . 0.0 105.513 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.265 2.5 p -115.31 166.82 11.44 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.646 1.178 . . . . 0.0 113.273 -175.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -40.47 -69.45 0.13 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 131.008 3.723 . . . . 0.0 119.286 -174.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -106.05 -36.21 7.01 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.535 1.934 . . . . 0.0 115.974 -174.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 33.7 m -69.06 167.44 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-O 123.244 1.497 . . . . 0.0 114.615 -175.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.66 145.37 38.07 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 103.206 -2.887 . . . . 0.0 103.206 174.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.2 tp -144.33 165.05 29.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 119.869 1.213 . . . . 0.0 107.751 -178.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.456 ' CZ ' HG23 ' A' ' 97' ' ' THR . 5.3 m-85 -130.89 152.58 50.07 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.247 -1.019 . . . . 0.0 108.247 176.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HB2' HG22 ' A' ' 31' ' ' THR . . . -152.97 135.51 15.18 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 119.037 0.835 . . . . 0.0 112.412 175.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -95.83 123.18 39.3 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 104.906 -2.257 . . . . 0.0 104.906 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 50.3 t -133.87 137.94 51.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -176.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -78.13 138.62 38.81 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -135.99 161.63 35.12 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.842 1.657 . . . . 0.0 107.489 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.3 m -126.64 113.42 16.7 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 120.755 -1.216 . . . . 0.0 108.473 -177.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 4.2 m -156.12 169.85 23.54 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 127.553 2.341 . . . . 0.0 105.981 175.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 100.42 144.47 15.86 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 103.98 -3.648 . . . . 0.0 103.98 -175.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -124.43 122.18 36.95 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 -175.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.53 176.1 10.07 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 126.167 1.787 . . . . 0.0 108.345 175.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 95.7 mtp -71.68 4.08 3.5 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.277 1.031 . . . . 0.0 111.829 175.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.5 m -146.4 175.67 10.37 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 119.856 -1.777 . . . . 0.0 108.823 -176.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.69 154.09 30.46 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.983 0.897 . . . . 0.0 108.984 -178.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -127.73 163.33 24.55 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.519 1.528 . . . . 0.0 108.297 -178.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.6 t -146.35 142.64 28.44 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -138.71 170.2 16.43 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.919 1.688 . . . . 0.0 106.966 176.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -146.38 129.77 16.77 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.8 133.93 49.74 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -99.88 113.21 25.6 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 102.296 -3.224 . . . . 0.0 102.296 175.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.2 mp -91.4 141.31 14.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -123.59 123.21 40.08 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 101.762 -3.422 . . . . 0.0 101.762 175.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.7 t-105 -95.44 123.41 38.96 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 103.84 -2.652 . . . . 0.0 103.84 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.677 HD11 HG21 ' A' ' 97' ' ' THR . 19.8 mt -142.41 85.7 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 102.384 -3.191 . . . . 0.0 102.384 175.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.69 144.48 7.19 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 176.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.9 tm-20 -57.28 -18.56 17.11 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -83.85 -36.23 23.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 124.778 1.231 . . . . 0.0 112.426 -177.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -73.87 123.32 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 107.216 -1.401 . . . . 0.0 107.216 175.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 5.1 t -146.22 176.38 9.79 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.717 1.207 . . . . 0.0 108.942 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 84.47 -148.7 24.13 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.743 -0.598 . . . . 0.0 111.719 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -54.75 -29.9 55.05 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.46 1.104 . . . . 0.0 109.309 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -57.64 -43.57 84.98 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.058 -1.026 . . . . 0.0 110.82 175.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -43.54 74.8 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 175.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.05 -31.07 64.8 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.237 0.615 . . . . 0.0 112.115 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -59.4 -61.42 2.64 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 175.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.677 HG21 HD11 ' A' ' 85' ' ' ILE . 96.4 m -53.75 -40.01 65.8 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 122.656 0.383 . . . . 0.0 110.676 178.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.68 -22.25 61.62 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 123.592 0.615 . . . . 0.0 114.296 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 63.7 m -108.49 -8.1 15.62 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.104 1.361 . . . . 0.0 111.902 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -103.27 -24.74 13.51 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.767 1.227 . . . . 0.0 112.189 -175.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -55.62 -33.27 63.84 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 120.294 1.406 . . . . 0.0 111.383 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.2 t -59.36 -36.84 76.48 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.95 0.795 . . . . 0.0 112.075 175.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.431 ' HB3' HG22 ' A' ' 8' ' ' ILE . 12.7 mt -63.19 -63.84 1.08 Allowed 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 125.14 1.376 . . . . 0.0 109.319 -175.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -32.88 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-O 117.73 -1.128 . . . . 0.0 109.793 175.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.81 -37.41 86.62 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.75 1.614 . . . . 0.0 110.418 176.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.33 -24.77 65.3 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.308 0.958 . . . . 0.0 111.374 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 58.9 t -84.98 -54.02 9.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 175.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 72.1 t -71.85 14.01 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 130.269 3.428 . . . . 0.0 113.35 -175.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -50.25 -26.55 4.84 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 119.759 -1.838 . . . . 0.0 115.119 -175.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -92.32 52.08 1.88 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.241 1.017 . . . . 0.0 109.646 175.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.08 176.46 5.12 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.72 2.008 . . . . 0.0 110.705 177.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.8 -67.07 0.86 Allowed 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -165.09 176.17 8.76 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 128.495 2.718 . . . . 0.0 108.734 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -113.61 173.61 6.33 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 124.663 1.185 . . . . 0.0 111.685 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -147.54 155.99 42.4 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 105.156 -2.164 . . . . 0.0 105.156 -175.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 14.3 t -129.08 124.9 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 175.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mt -125.19 141.29 45.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 125.804 1.641 . . . . 0.0 107.867 -175.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 10.2 p -131.07 -9.81 3.81 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -175.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -145.97 160.64 41.57 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 118.447 0.567 . . . . 0.0 110.771 -175.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -53.38 -42.86 67.35 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.254 1.421 . . . . 0.0 111.204 176.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -67.47 -37.15 82.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.636 0.653 . . . . 0.0 111.989 -179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -71.77 -23.66 61.63 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.896 0.879 . . . . 0.0 110.545 177.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -80.77 -24.56 38.55 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.095 -1.003 . . . . 0.0 113.38 -176.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -61.5 123.61 18.34 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.904 0.774 . . . . 0.0 111.492 -175.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -54.66 -23.61 18.1 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -56.42 -49.99 72.95 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 -175.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -88.94 -25.65 21.96 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.873 177.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 34.5 mt -52.7 -43.41 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -55.0 -50.48 68.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 119.083 -0.484 . . . . 0.0 111.048 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.5 t -64.08 -43.32 95.77 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-O 118.803 -0.618 . . . . 0.0 110.604 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -53.65 -52.81 58.75 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.543 1.137 . . . . 0.0 109.372 177.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.12 -29.29 70.13 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.008 0.923 . . . . 0.0 112.159 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -72.29 -44.27 63.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.393 1.077 . . . . 0.0 110.018 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 45.8 mmtt -60.53 -53.53 56.46 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 176.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.19 -9.88 12.98 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.186 1.394 . . . . 0.0 113.103 178.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -72.06 -18.68 77.98 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 119.322 0.964 . . . . 0.0 111.823 175.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -74.96 145.93 34.34 Favored Glycine 0 C--N 1.338 0.665 0 N-CA-C 109.193 -1.563 . . . . 0.0 109.193 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -73.49 146.82 44.62 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 118.309 1.054 . . . . 0.0 110.036 176.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -150.15 124.37 9.48 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 175.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -147.42 99.73 3.17 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 123.721 0.809 . . . . 0.0 109.371 -175.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -129.86 141.88 50.75 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.621 1.168 . . . . 0.0 108.783 175.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -144.09 120.78 11.17 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 126.133 1.773 . . . . 0.0 107.245 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -137.03 160.15 39.78 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 126.178 1.791 . . . . 0.0 108.593 177.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 41.81 44.94 2.99 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.573 2.349 . . . . 0.0 110.68 -175.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 117.715 -1.136 . . . . 0.0 109.513 -179.376 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.063 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 28.1 mm -137.63 -73.06 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-N 118.718 1.259 . . . . 0.0 109.292 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -77.82 72.85 4.39 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.286 0.948 . . . . 0.0 110.43 -175.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 45.0 mtm -147.2 176.48 9.94 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 128.326 2.65 . . . . 0.0 107.513 175.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.27 59.64 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 127.992 2.517 . . . . 0.0 114.137 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.3 m -64.05 157.33 25.54 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.51 2.324 . . . . 0.0 108.409 176.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -131.74 175.44 9.19 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.266 1.026 . . . . 0.0 110.119 -176.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.647 HG22 HG12 ' A' ' 39' ' ' ILE . 0.1 OUTLIER -121.42 151.98 24.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 O-C-N 121.541 -0.725 . . . . 0.0 110.247 176.017 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -87.19 65.71 8.95 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 104.87 -2.271 . . . . 0.0 104.87 175.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.93 -39.93 63.22 Favored 'General case' 0 CA--C 1.512 -0.482 0 C-N-CA 124.395 1.078 . . . . 0.0 111.931 -175.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -67.84 -35.23 78.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 118.753 0.706 . . . . 0.0 111.771 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.29 -50.26 16.64 Favored 'General case' 0 CA--C 1.523 -0.084 0 CA-C-N 119.727 1.149 . . . . 0.0 109.882 175.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.0 m -62.36 -27.79 69.31 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.906 -0.496 . . . . 0.0 110.996 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -58.52 -41.61 85.84 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 117.72 -1.133 . . . . 0.0 109.518 175.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.54 -54.32 38.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 123.779 0.674 . . . . 0.0 110.116 -175.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.08 75.15 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -52.94 -40.66 63.82 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 119.015 -0.517 . . . . 0.0 109.618 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -58.43 -48.77 79.62 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 123.448 0.699 . . . . 0.0 111.013 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mp -54.33 -56.36 19.25 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 124.029 0.932 . . . . 0.0 110.856 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.0 -30.08 48.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 O-C-N 122.146 -0.346 . . . . 0.0 111.089 -176.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.0 ttp85 -76.89 -25.05 52.59 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.382 1.073 . . . . 0.0 112.273 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -83.67 124.35 30.75 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 126.185 1.794 . . . . 0.0 112.313 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -64.83 -22.27 66.95 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 123.924 0.89 . . . . 0.0 112.869 175.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.76 -14.35 75.77 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-N 119.169 0.895 . . . . 0.0 112.854 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.5 t -70.13 146.03 51.13 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.898 1.349 . . . . 0.0 111.942 -175.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.03 -29.58 23.34 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 175.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.8 t -74.86 129.95 36.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 176.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.87 -24.02 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 O-C-N 124.296 0.997 . . . . 0.0 110.235 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -125.45 144.65 50.43 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 124.349 1.06 . . . . 0.0 109.275 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.9 t -137.53 162.78 32.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 C-N-CA 128.501 2.72 . . . . 0.0 107.631 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 51.0 p -132.06 162.22 31.31 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.601 1.161 . . . . 0.0 108.174 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -133.92 143.82 48.46 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -120.64 176.67 5.4 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.405 ' CE2' HD12 ' A' ' 39' ' ' ILE . 23.9 m-85 -120.33 141.01 50.42 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 123.479 0.712 . . . . 0.0 109.118 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -151.09 123.83 8.56 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.066 0.946 . . . . 0.0 109.285 175.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 54.19 -125.9 34.91 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.1 p -98.34 30.05 3.34 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 124.516 1.127 . . . . 0.0 111.945 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.6 t -151.84 165.4 34.62 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 175.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.647 HG12 HG22 ' A' ' 8' ' ' ILE . 12.2 mm -89.41 135.03 27.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 103.743 -2.688 . . . . 0.0 103.743 175.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.437 ' HB ' ' HD2' ' A' ' 41' ' ' PRO . 6.0 m -122.34 167.19 14.66 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 124.687 1.195 . . . . 0.0 109.297 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.437 ' HD2' ' HB ' ' A' ' 40' ' ' VAL . 57.0 Cg_endo -66.06 170.08 12.4 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 CA-C-N 120.506 1.216 . . . . 0.0 111.302 176.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -135.41 -168.11 11.5 Favored Glycine 0 CA--C 1.523 0.559 0 C-N-CA 125.614 1.578 . . . . 0.0 109.85 176.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -74.69 170.46 15.78 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 124.566 1.146 . . . . 0.0 109.731 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -146.46 168.47 21.12 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 124.949 1.3 . . . . 0.0 110.206 -176.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.33 -178.03 46.67 Favored Glycine 0 CA--C 1.521 0.41 0 CA-C-O 121.968 0.76 . . . . 0.0 112.772 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.76 -24.11 7.31 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.552 1.541 . . . . 0.0 110.776 176.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -109.12 123.21 48.83 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.4 ' CD1' ' HG3' ' A' ' 125' ' ' GLU . 33.3 t80 -83.1 -15.88 49.08 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.368 -175.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -54.11 -34.54 60.52 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 121.468 1.94 . . . . 0.0 111.666 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -66.16 -32.98 74.75 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 123.429 0.692 . . . . 0.0 112.123 175.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -52.95 -45.59 67.79 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.292 1.437 . . . . 0.0 109.622 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 mp -63.46 -33.12 59.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.507 -0.745 . . . . 0.0 110.958 -178.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -80.21 -26.45 39.15 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.961 1.304 . . . . 0.0 110.269 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -71.98 -39.02 69.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.451 1.5 . . . . 0.0 110.278 176.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 67.4 m -50.49 114.36 1.11 Allowed 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.953 1.301 . . . . 0.0 111.246 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.619 ' OG1' HG22 ' A' ' 59' ' ' VAL . 2.7 p -84.26 143.24 29.69 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 127.995 2.518 . . . . 0.0 110.635 -176.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -50.54 -59.74 3.72 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 126.172 1.789 . . . . 0.0 112.94 -177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -106.67 -33.79 7.51 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 125.496 1.518 . . . . 0.0 113.927 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.619 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -72.31 155.11 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 C-N-CA 118.086 -1.446 . . . . 0.0 109.429 -175.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.7 151.44 22.99 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -178.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.3 tp -147.48 157.35 43.53 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 124.424 1.09 . . . . 0.0 108.478 -175.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -128.84 142.77 50.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -137.46 124.08 21.01 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 123.838 0.855 . . . . 0.0 112.001 -176.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -95.85 123.57 39.49 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 105.27 -2.122 . . . . 0.0 105.27 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.9 t -136.53 143.57 35.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 123.365 0.666 . . . . 0.0 109.395 -175.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.52 136.2 33.21 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -136.27 170.76 15.51 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.755 2.022 . . . . 0.0 107.81 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 m -132.99 127.79 34.93 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.639 1.576 . . . . 0.0 110.116 176.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.9 m -156.42 152.42 27.48 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 175.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.77 131.58 1.36 Allowed Glycine 0 C--N 1.332 0.334 0 N-CA-C 103.896 -3.682 . . . . 0.0 103.896 -175.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -137.29 149.88 47.4 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -174.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.28 -173.03 4.07 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 131.314 3.846 . . . . 0.0 105.128 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 27.9 mmt -62.88 -6.37 3.71 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 120.318 1.417 . . . . 0.0 110.969 175.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 28.5 m -125.63 143.23 51.12 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 130.028 3.331 . . . . 0.0 105.979 175.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -67.79 154.57 41.23 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 87.9 mtt-85 -111.8 165.68 11.85 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 175.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.7 t -133.51 135.99 44.78 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 -176.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.7 mtpp -139.87 123.97 17.75 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 125.933 1.693 . . . . 0.0 107.791 -175.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.57 134.76 33.62 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 176.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -108.01 127.9 54.18 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.542 1.537 . . . . 0.0 107.169 176.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -103.99 113.27 26.69 Favored 'General case' 0 CA--C 1.521 -0.158 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 175.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.8 mp -93.74 135.46 28.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 -177.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -117.38 123.47 46.52 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 106.071 -1.825 . . . . 0.0 106.071 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 52.1 t-105 -100.96 123.41 45.11 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 105.745 -1.946 . . . . 0.0 105.745 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.7 mm -141.56 89.84 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 101.001 -3.703 . . . . 0.0 101.001 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.48 145.0 8.25 Favored Glycine 0 C--N 1.339 0.726 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.44 -5.44 7.72 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.103 0.951 . . . . 0.0 113.134 -175.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -83.3 -35.5 25.2 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 124.799 1.24 . . . . 0.0 111.771 176.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.2 p -82.71 132.78 30.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 120.074 1.307 . . . . 0.0 109.656 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.5 t -146.22 176.56 9.66 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 126.674 1.99 . . . . 0.0 108.589 -175.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 81.29 -155.48 36.2 Favored Glycine 0 CA--C 1.519 0.311 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.49 -29.56 59.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 122.963 0.505 . . . . 0.0 110.959 -177.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 -57.22 -39.41 75.42 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.872 1.669 . . . . 0.0 111.334 176.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -71.45 -53.05 15.28 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 175.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.65 -23.39 6.49 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 117.225 -1.369 . . . . 0.0 113.527 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -48.82 -44.11 38.98 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 120.678 1.581 . . . . 0.0 109.184 175.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.2 m -56.29 -27.78 56.57 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.983 1.713 . . . . 0.0 111.918 178.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -75.95 -25.92 65.75 Favored Glycine 0 CA--C 1.529 0.943 0 O-C-N 120.809 -1.182 . . . . 0.0 112.449 175.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 54.6 m -93.32 -20.18 20.64 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.806 1.242 . . . . 0.0 110.136 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -104.14 -23.97 13.22 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -174.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -58.14 -33.04 68.75 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 122.353 2.342 . . . . 0.0 111.225 177.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.9 t -68.53 -27.49 66.15 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.663 1.12 . . . . 0.0 112.25 175.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.42 ' O ' HG21 ' A' ' 8' ' ' ILE . 15.5 mt -67.85 -62.16 1.54 Allowed 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.301 0.8 OUTLIER -57.87 -24.69 23.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.313 175.471 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -63.79 -33.19 75.11 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.814 1.643 . . . . 0.0 109.57 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -62.34 -24.26 67.23 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 120.665 1.575 . . . . 0.0 111.816 175.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 92.2 t -86.01 -63.4 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 41.5 t -73.13 26.16 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 131.64 3.976 . . . . 0.0 112.71 -175.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -54.25 -26.0 26.41 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 119.751 -1.843 . . . . 0.0 111.643 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -97.37 88.84 4.52 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 175.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -153.08 176.44 11.9 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.436 0.636 . . . . 0.0 111.003 176.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -108.61 -66.03 1.08 Allowed 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.432 1.093 . . . . 0.0 109.982 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.98 174.88 11.11 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 119.044 0.838 . . . . 0.0 109.464 178.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . 0.254 0.0 OUTLIER -118.84 169.62 9.7 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.625 1.17 . . . . 0.0 109.599 175.495 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.415 ' CD1' HD11 ' A' ' 117' ' ' ILE . 0.5 OUTLIER -144.15 149.15 36.02 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 104.205 -2.517 . . . . 0.0 104.205 -175.662 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.31 123.47 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.415 HD11 ' CD1' ' A' ' 115' ' ' PHE . 2.8 mp -130.87 145.22 35.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 C-N-CA 125.286 1.434 . . . . 0.0 107.889 -176.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 p -136.65 -9.46 1.88 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.741 1.216 . . . . 0.0 113.76 -176.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -115.42 124.46 51.22 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 176.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 17.8 ttp-105 -59.49 -36.68 76.52 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.92 0.888 . . . . 0.0 111.721 -177.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -35.96 77.05 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 120.254 1.388 . . . . 0.0 111.422 177.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.88 -41.52 91.48 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 123.744 0.653 . . . . 0.0 110.324 -175.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -43.61 -23.11 0.06 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 131.456 3.903 . . . . 0.0 115.425 -176.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -43.93 141.41 1.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.014 1.726 . . . . 0.0 111.222 175.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.4 ' HG3' ' CD1' ' A' ' 48' ' ' TYR . 7.2 mt-10 -61.42 -21.84 64.46 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -175.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.485 ' HA ' ' HE3' ' A' ' 129' ' ' LYS 0.276 7.9 t70 -65.81 -43.57 88.27 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 121.541 1.973 . . . . 0.0 113.448 -175.168 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.16 -26.39 60.28 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 113.84 -3.144 . . . . 0.0 106.44 -176.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 58.5 mt -60.64 -49.54 84.04 Favored 'Isoleucine or valine' 0 C--N 1.345 0.39 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 175.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.485 ' HE3' ' HA ' ' A' ' 126' ' ' ASP . 15.4 mtmt -56.26 -45.91 79.88 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.554 -0.716 . . . . 0.0 111.327 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -73.53 -38.17 65.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 119.403 1.002 . . . . 0.0 110.904 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -66.52 -43.73 84.42 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.51 1.524 . . . . 0.0 109.879 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.06 -36.69 82.39 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.4 mttp -67.2 -41.4 85.88 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 124.551 1.14 . . . . 0.0 111.429 175.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -62.02 -41.35 97.99 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 120.832 1.651 . . . . 0.0 109.135 175.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.27 -0.32 14.13 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.667 0.787 . . . . 0.0 112.212 175.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -82.21 64.91 4.17 Favored Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 107.882 -2.087 . . . . 0.0 107.882 175.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -53.29 148.26 15.23 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 108.368 -1.893 . . . . 0.0 108.368 175.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -53.96 94.48 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.916 1.286 . . . . 0.0 112.336 -175.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -129.75 60.78 1.58 Allowed 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 175.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -115.25 90.81 3.43 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 105.052 -2.203 . . . . 0.0 105.052 -178.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -145.71 153.61 41.17 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 128.558 2.743 . . . . 0.0 104.913 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.86 78.5 1.25 Allowed 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.203 1.401 . . . . 0.0 107.653 -176.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -75.59 70.72 2.45 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 176.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.9 m 62.9 56.06 1.92 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.738 1.615 . . . . 0.0 108.414 -175.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 . . . . . 0 C--O 1.251 1.171 0 C-N-CA 125.914 1.686 . . . . 0.0 106.646 178.589 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.57 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 5.4 mp -129.09 -104.69 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 N-CA-C 104.948 -2.241 . . . . 0.0 104.948 172.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 6.5 ttp85 -142.28 111.24 6.34 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 105.838 -1.912 . . . . 0.0 105.838 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 6.0 ttt -156.3 141.2 17.16 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 -177.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -115.92 83.74 1.99 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.162 0.985 . . . . 0.0 109.323 175.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 61.2 m -116.23 161.14 19.42 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 103.766 -2.679 . . . . 0.0 103.766 175.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.536 ' HG2' ' H ' ' A' ' 8' ' ' ILE . 38.6 tttt -132.26 -174.01 3.32 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 121.144 -0.973 . . . . 0.0 110.555 -175.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.536 ' H ' ' HG2' ' A' ' 7' ' ' LYS . 0.2 OUTLIER -132.39 151.68 35.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 125.825 1.65 . . . . 0.0 108.298 175.647 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -103.2 86.32 2.66 Favored 'General case' 0 C--O 1.236 0.352 1 N-CA-C 98.488 -4.634 . . . . 0.0 98.488 174.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -55.13 -29.37 57.57 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 116.899 -1.524 . . . . 0.0 113.757 -175.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -74.33 -50.43 18.78 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 120.878 1.672 . . . . 0.0 110.222 -176.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.14 90.0 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.63 ' HB3' HG11 ' A' ' 107' ' ' VAL . 17.1 m -68.88 -41.95 77.63 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.526 -0.734 . . . . 0.0 112.117 175.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -57.06 -37.62 72.09 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 117.85 -1.071 . . . . 0.0 109.855 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.27 -35.6 69.96 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 119.005 0.82 . . . . 0.0 111.984 -176.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.59 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -78.43 -50.17 12.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 119.185 0.902 . . . . 0.0 111.274 175.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -49.47 -43.76 45.39 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.757 1.223 . . . . 0.0 110.13 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -64.77 -43.38 93.44 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 118.348 -0.834 . . . . 0.0 111.841 -177.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.79 -52.26 65.82 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 119.224 0.92 . . . . 0.0 111.385 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.458 ' CG2' HG23 ' A' ' 30' ' ' VAL . 93.8 t -60.35 -34.27 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 122.439 0.296 . . . . 0.0 110.216 -177.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.4 ttt-85 -72.56 -32.57 66.14 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 125.158 1.383 . . . . 0.0 113.124 176.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -66.22 149.3 50.54 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.957 1.303 . . . . 0.0 113.887 -175.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.57 -23.21 34.57 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.781 1.233 . . . . 0.0 113.162 -177.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.77 -14.67 24.55 Favored Glycine 0 CA--C 1.527 0.807 0 CA-C-N 118.782 0.719 . . . . 0.0 112.538 -177.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -64.95 123.71 20.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 118.304 1.052 . . . . 0.0 109.214 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.07 -31.94 69.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.248 175.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 t -60.62 129.41 23.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 176.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.4 HD12 HG13 ' A' ' 65' ' ' VAL . 1.1 pp -114.69 -24.43 3.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 124.075 0.859 . . . . 0.0 110.603 178.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -129.68 137.84 50.84 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-N 119.646 1.112 . . . . 0.0 109.685 -178.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.59 HG11 ' HB1' ' A' ' 16' ' ' ALA . 23.6 t -140.6 148.39 22.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 175.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 42.1 p -105.56 160.32 15.27 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.133 0.492 . . . . 0.0 111.324 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -129.25 123.08 31.03 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 104.347 -2.464 . . . . 0.0 104.347 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.0 mmtm -100.49 176.66 5.27 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 127.407 2.283 . . . . 0.0 105.921 177.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -115.82 153.62 31.15 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -137.74 152.96 49.75 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 128.991 2.916 . . . . 0.0 105.86 175.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 12.87 -80.33 0.0 OUTLIER Glycine 0 C--N 1.339 0.737 0 C-N-CA 128.038 2.732 . . . . 0.0 115.67 175.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.9 p -129.8 23.91 5.37 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.515 1.126 . . . . 0.0 113.569 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.0 t -151.21 171.63 17.1 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -176.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 12.3 mm -92.93 139.61 17.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 C-N-CA 125.898 1.679 . . . . 0.0 107.439 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.6 m -131.48 153.93 81.73 Favored Pre-proline 0 N--CA 1.472 0.628 0 C-N-CA 124.436 1.094 . . . . 0.0 111.387 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.33 153.71 50.78 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 121.736 1.624 . . . . 0.0 109.491 175.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.69 -142.62 6.97 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 125.484 1.516 . . . . 0.0 110.744 177.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -72.73 165.39 24.9 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.841 1.256 . . . . 0.0 109.755 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.456 ' HB3' HG13 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -145.08 165.1 29.21 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 125.772 1.629 . . . . 0.0 110.809 177.087 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.6 173.78 42.01 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-O 122.731 1.184 . . . . 0.0 112.962 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.46 7.47 5.34 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.484 2.314 . . . . 0.0 110.093 176.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -133.03 127.04 33.21 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 103.422 -2.807 . . . . 0.0 103.422 -175.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -84.43 -15.99 44.22 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 115.611 1.708 . . . . 0.0 115.611 -175.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -58.7 -40.19 82.92 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 121.959 2.163 . . . . 0.0 109.937 176.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -60.47 -30.58 69.77 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.767 0.427 . . . . 0.0 111.039 175.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -69.66 -36.12 75.77 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.539 -0.726 . . . . 0.0 109.652 178.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.5 mm -62.87 -46.95 95.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -63.6 -35.96 82.23 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.863 1.665 . . . . 0.0 111.926 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.0 -22.98 65.04 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 124.716 1.207 . . . . 0.0 114.049 177.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.9 m -64.23 113.99 3.94 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 119.377 0.989 . . . . 0.0 108.83 -178.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.254 2.3 p -103.36 154.85 18.96 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.495 1.118 . . . . 0.0 108.168 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -41.48 -74.76 0.03 OUTLIER 'General case' 0 C--O 1.234 0.272 0 N-CA-C 117.943 2.572 . . . . 0.0 117.943 -174.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -106.17 -36.14 6.99 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -175.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.7 m -53.75 132.16 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 123.235 0.614 . . . . 0.0 110.265 -175.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.51 123.11 46.3 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 -177.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 32.7 tp -122.42 176.11 6.07 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 127.023 2.129 . . . . 0.0 111.284 -174.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -136.48 151.76 49.81 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.49 0.716 . . . . 0.0 110.233 176.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -142.92 123.42 13.99 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.739 0.815 . . . . 0.0 111.295 175.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.42 ' CD1' HG13 ' A' ' 108' ' ' VAL . 40.2 t80 -88.41 123.88 33.4 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 104.65 -2.352 . . . . 0.0 104.65 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.407 HG21 HD13 ' A' ' 82' ' ' ILE . 44.4 t -134.28 140.54 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-N 118.103 0.41 . . . . 0.0 109.919 -175.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.9 tmm_? -85.42 117.84 24.59 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 175.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -112.23 123.45 50.3 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 108.696 -175.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.1 m -73.78 116.14 14.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 176.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 85.6 m -84.31 169.72 14.38 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 124.429 1.091 . . . . 0.0 110.564 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -56.2 130.36 49.3 Favored Glycine 0 C--N 1.34 0.798 0 N-CA-C 108.304 -1.918 . . . . 0.0 108.304 176.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -65.91 160.73 22.79 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 126.355 1.862 . . . . 0.0 113.302 -175.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.51 -173.62 4.25 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 130.221 3.408 . . . . 0.0 106.3 175.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -63.51 -5.87 4.35 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.414 -0.804 . . . . 0.0 112.371 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.1 m -135.74 158.27 44.81 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 127.599 2.359 . . . . 0.0 106.794 175.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -57.09 150.2 17.75 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 123.455 0.702 . . . . 0.0 109.703 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 75.2 mmt-85 -135.4 134.04 39.29 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 105.823 -1.918 . . . . 0.0 105.823 175.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.2 t -146.59 139.12 25.11 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 124.461 1.105 . . . . 0.0 108.316 -176.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -142.41 176.63 8.85 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.508 1.523 . . . . 0.0 107.214 177.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -131.52 124.35 29.91 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 -176.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -111.56 114.12 26.98 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 104.108 -2.553 . . . . 0.0 104.108 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.9 tt -82.88 113.15 20.3 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 105.361 -2.088 . . . . 0.0 105.361 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.561 HG23 HD12 ' A' ' 117' ' ' ILE . 3.1 mp -79.4 123.8 36.8 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 N-CA-C 105.458 -2.053 . . . . 0.0 105.458 175.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.8 m -106.4 123.11 47.57 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 101.242 -3.614 . . . . 0.0 101.242 175.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -95.49 124.06 39.34 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.475 HD11 HG21 ' A' ' 97' ' ' THR . 10.5 mm -133.94 81.92 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 N-CA-C 103.696 -2.705 . . . . 0.0 103.696 177.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -44.26 130.47 7.09 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 107.986 -2.046 . . . . 0.0 107.986 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -56.0 -10.64 0.84 Allowed 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -83.21 -28.17 29.45 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 117.576 -1.202 . . . . 0.0 110.804 177.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.7 p -71.03 133.53 31.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 120.744 1.611 . . . . 0.0 109.064 -177.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 42.5 t -146.31 176.18 9.96 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.84 1.656 . . . . 0.0 107.011 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.65 -157.2 53.52 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 95' ' ' ALA . 5.1 tt -60.23 -30.98 69.76 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-O 118.049 -0.977 . . . . 0.0 112.047 -175.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -58.17 -45.15 87.98 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 120.304 1.411 . . . . 0.0 110.109 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -36.25 76.98 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 175.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.421 ' HB3' ' HA ' ' A' ' 92' ' ' LEU . . . -62.32 -23.57 66.82 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.084 -0.96 . . . . 0.0 112.573 177.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -56.19 -54.35 46.25 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-N 119.919 1.236 . . . . 0.0 108.861 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.475 HG21 HD11 ' A' ' 85' ' ' ILE . 54.0 m -52.28 -40.41 61.72 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 175.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -55.4 -24.78 39.22 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-O 118.864 -0.964 . . . . 0.0 115.415 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.2 m -115.7 -6.64 12.15 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.184 1.492 . . . . 0.0 112.201 176.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -103.91 -23.46 13.36 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 125.733 1.613 . . . . 0.0 111.974 -175.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.4 mtmp? -53.31 -29.88 36.0 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.44 1.473 . . . . 0.0 111.981 176.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -63.69 -36.83 85.15 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.942 0.897 . . . . 0.0 111.137 176.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 18.1 mt -64.81 -62.27 1.67 Allowed 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 125.363 1.465 . . . . 0.0 108.723 -176.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.409 ' H ' HG12 ' A' ' 104' ' ' VAL 0.264 0.9 OUTLIER -61.14 -28.1 43.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.472 176.354 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 34.1 tttm -62.14 -40.56 96.35 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 121.246 1.839 . . . . 0.0 109.43 175.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -57.51 -24.51 56.33 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.687 1.13 . . . . 0.0 112.253 177.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.63 HG11 ' HB3' ' A' ' 13' ' ' CYS . 55.3 t -84.62 -63.24 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 175.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.42 HG13 ' CD1' ' A' ' 64' ' ' PHE . 87.1 t -65.22 26.46 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.873 1 C-N-CA 132.289 4.236 . . . . 0.0 113.644 -175.612 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -54.12 -27.05 30.81 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 119.314 -2.116 . . . . 0.0 114.035 -175.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -90.78 79.86 5.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 175.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -148.58 176.32 10.43 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 122.375 0.27 . . . . 0.0 110.591 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -112.42 -59.29 2.02 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.982 0.913 . . . . 0.0 111.04 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -147.54 171.94 14.77 Favored 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 125.335 1.454 . . . . 0.0 110.248 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -123.51 134.02 53.93 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -107.1 144.37 33.89 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 104.998 -2.223 . . . . 0.0 104.998 -174.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.6 t -104.0 123.54 57.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 175.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.561 HD12 HG23 ' A' ' 82' ' ' ILE . 98.9 mt -129.08 137.25 57.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 106.225 -1.768 . . . . 0.0 106.225 -175.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 52.5 p -142.69 -4.01 0.98 Allowed 'General case' 0 C--O 1.239 0.528 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -175.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -146.82 152.13 38.24 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.103 1.361 . . . . 0.0 109.229 -175.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -60.11 -36.17 76.85 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 117.313 -1.327 . . . . 0.0 112.361 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -63.08 -37.45 87.27 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 121.273 1.851 . . . . 0.0 110.584 176.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -68.13 -23.17 64.86 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.108 2.163 . . . . 0.0 111.485 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -84.82 -23.37 29.13 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.256 1.822 . . . . 0.0 113.349 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -59.35 125.76 24.9 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 120.102 1.319 . . . . 0.0 112.12 -175.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -56.9 -27.93 61.33 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.254 -0.904 . . . . 0.0 113.316 176.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -54.59 -60.68 3.03 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 123.575 0.75 . . . . 0.0 111.249 -177.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -80.56 -24.22 39.39 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 117.769 -1.572 . . . . 0.0 109.017 -175.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 27.8 mt -54.47 -47.34 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 175.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -54.09 -49.89 68.07 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 118.78 0.718 . . . . 0.0 112.038 175.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.8 t -71.91 -29.16 64.02 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.598 0.635 . . . . 0.0 111.661 -176.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -72.11 -47.14 53.43 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 119.301 0.955 . . . . 0.0 109.165 176.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 78.0 mt -60.17 -36.95 78.73 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 175.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 6.0 mtmt -61.68 -53.21 59.21 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 175.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? -57.05 -45.77 82.96 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.976 1.262 . . . . 0.0 111.209 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.68 -3.67 23.06 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 117.964 -1.017 . . . . 0.0 112.873 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -106.06 155.82 16.59 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 108.901 -1.68 . . . . 0.0 108.901 175.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 158.26 95.34 0.11 Allowed Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 107.658 -2.177 . . . . 0.0 107.658 -176.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -154.65 137.73 15.57 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 125.902 1.681 . . . . 0.0 107.606 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -69.52 117.91 11.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -114.32 100.47 8.36 Favored 'General case' 0 N--CA 1.438 -1.036 0 N-CA-C 100.971 -3.714 . . . . 0.0 100.971 175.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -63.39 156.73 25.08 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 125.112 1.365 . . . . 0.0 109.737 -175.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -132.2 94.81 3.53 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -178.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -143.73 129.23 19.05 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 101.411 -3.551 . . . . 0.0 101.411 175.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 63.85 31.86 13.74 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -175.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 . . . . . 0 C--O 1.244 0.801 1 C-N-CA 133.694 4.798 . . . . 0.0 103.572 -177.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.675 0 N-CA-C 111.161 -0.776 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.3 tt -87.8 150.87 3.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 166.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.52 64.63 1.65 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 122.101 0.953 . . . . 0.0 109.044 175.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 8.6 ttm -150.17 175.46 11.74 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 128.277 2.631 . . . . 0.0 105.564 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.53 144.57 56.89 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.541 1.064 . . . . 0.0 109.712 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.433 ' HB ' HD11 ' A' ' 103' ' ' LEU . 3.2 m -142.6 162.07 36.42 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.565 1.946 . . . . 0.0 106.621 -176.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.1 mtpt -131.62 -173.06 3.02 Favored 'General case' 0 CA--C 1.516 -0.328 0 O-C-N 121.316 -0.865 . . . . 0.0 111.303 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.13 148.38 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 C-N-CA 126.908 2.083 . . . . 0.0 105.654 175.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -88.31 74.05 8.74 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 101.9 -3.37 . . . . 0.0 101.9 175.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.85 -44.61 59.52 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 125.391 1.477 . . . . 0.0 112.875 -174.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -65.47 -49.34 69.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.083 0.856 . . . . 0.0 109.738 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.56 -34.39 74.11 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.322 -0.861 . . . . 0.0 112.0 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.5 m -74.78 -38.02 62.27 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.451 178.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.2 ttm180 -59.95 -27.25 66.65 Favored 'General case' 0 C--N 1.342 0.263 0 CA-C-O 116.975 -1.488 . . . . 0.0 111.17 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.06 -60.78 3.24 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 120.089 1.313 . . . . 0.0 110.465 176.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.445 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -62.38 -40.2 95.66 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.013 0.824 . . . . 0.0 111.073 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -58.77 -36.34 74.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.545 176.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -62.19 -44.96 95.41 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 119.925 1.239 . . . . 0.0 110.604 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.6 mp -56.68 -61.84 2.14 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 175.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.418 ' CG2' HG23 ' A' ' 30' ' ' VAL . 42.3 t -58.21 -34.44 49.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 O-C-N 121.742 -0.599 . . . . 0.0 111.498 -176.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.2 ttt-85 -67.71 -38.16 83.25 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 124.683 1.193 . . . . 0.0 111.213 175.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -66.56 137.07 56.5 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.891 0.876 . . . . 0.0 108.737 178.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.6 -11.06 57.8 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 125.279 1.432 . . . . 0.0 111.373 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -98.45 5.85 60.82 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.724 1.63 . . . . 0.0 112.225 175.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -85.63 141.55 29.72 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.248 1.524 . . . . 0.0 109.936 176.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -80.28 -29.0 38.24 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 175.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.9 t -73.62 125.03 32.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 175.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 pp -115.16 -24.49 3.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.816 1.246 . . . . 0.0 111.312 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 35.0 p-90 -125.38 145.21 50.15 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 119.224 0.92 . . . . 0.0 108.777 177.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.445 HG21 ' HB1' ' A' ' 16' ' ' ALA . 6.1 t -135.71 158.84 39.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 127.389 2.276 . . . . 0.0 106.151 176.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.449 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 42.0 p -119.15 154.5 33.19 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -126.69 123.58 37.85 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 176.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -107.04 176.72 5.08 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.171 2.188 . . . . 0.0 105.347 -175.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -116.94 155.53 28.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.485 0.659 . . . . 0.0 109.509 176.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -142.26 166.71 23.94 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 127.306 2.242 . . . . 0.0 105.906 175.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 14.07 -88.78 0.0 OUTLIER Glycine 0 CA--C 1.531 1.06 0 C-N-CA 128.385 2.898 . . . . 0.0 114.988 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 p -135.59 44.17 2.55 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 126.24 1.816 . . . . 0.0 109.312 175.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -155.1 174.29 15.39 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -176.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.3 mm -103.47 139.55 24.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 126.22 1.808 . . . . 0.0 106.968 175.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 16.6 m -135.66 160.54 67.25 Favored Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 124.98 1.312 . . . . 0.0 110.902 -178.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.87 149.11 53.15 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.525 2.15 . . . . 0.0 110.444 175.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -115.43 -145.95 8.72 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 126.706 2.098 . . . . 0.0 109.676 175.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -70.26 164.65 23.92 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -144.95 168.64 19.76 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.849 1.26 . . . . 0.0 108.49 175.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.81 174.92 46.91 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-O 121.88 0.711 . . . . 0.0 113.076 -177.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.64 -26.07 8.81 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.693 1.997 . . . . 0.0 110.691 176.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.02 129.18 55.45 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 -176.116 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -83.94 -8.5 59.15 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.404 1.261 . . . . 0.0 114.404 -174.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -58.56 -40.12 82.18 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 119.497 -2.002 . . . . 0.0 109.048 175.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -66.48 -22.54 66.19 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.597 -0.689 . . . . 0.0 111.601 176.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -66.61 -36.25 82.14 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-N 119.472 1.033 . . . . 0.0 109.801 176.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.9 mm -60.02 -39.7 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -72.7 -23.35 60.86 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.849 1.66 . . . . 0.0 113.313 175.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -73.97 -24.92 59.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 120.79 1.632 . . . . 0.0 110.036 175.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 79.9 m -71.56 159.37 34.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.598 -0.689 . . . . 0.0 109.432 176.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.629 ' OG1' HG22 ' A' ' 59' ' ' VAL . 16.7 p -132.63 -174.33 3.43 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.73 1.212 . . . . 0.0 112.644 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -77.01 -67.46 0.71 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.304 1.442 . . . . 0.0 108.448 175.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -106.45 -27.92 10.64 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 118.199 2.666 . . . . 0.0 118.199 -175.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.629 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -65.58 167.77 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-N 121.997 2.18 . . . . 0.0 113.428 -175.162 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.2 124.87 45.74 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 175.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 56.2 tp -129.02 159.09 37.02 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 126.171 1.788 . . . . 0.0 107.962 -175.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -123.81 157.82 33.21 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.449 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -147.2 141.62 26.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 118.126 0.421 . . . . 0.0 111.319 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -106.54 123.58 48.31 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 176.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.2 t -135.62 138.15 48.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.834 0.826 . . . . 0.0 112.136 -175.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.5 ttm-85 -79.33 117.71 20.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 128.388 2.675 . . . . 0.0 107.15 175.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -136.18 167.75 20.69 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.7 m -128.67 130.44 47.22 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 120.8 -1.187 . . . . 0.0 107.804 175.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 m -154.84 121.51 5.42 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 175.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 75.29 121.72 0.12 Allowed Glycine 0 C--N 1.332 0.338 0 N-CA-C 107.162 -2.375 . . . . 0.0 107.162 -175.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . 0.275 6.1 m-20 -118.22 176.43 5.23 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.237 -0.981 . . . . 0.0 112.052 -175.099 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -144.49 -173.01 3.92 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 127.968 2.507 . . . . 0.0 107.317 -175.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 57.6 mtm -54.46 -5.85 0.09 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.923 0.889 . . . . 0.0 112.867 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 75.3 m -146.15 150.26 35.55 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 130.088 3.355 . . . . 0.0 103.76 175.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -64.37 158.5 23.47 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.661 -176.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.9 mtt180 -116.61 170.87 8.25 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.7 t -145.64 124.3 12.54 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 175.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -116.64 123.35 47.07 Favored 'General case' 0 CA--C 1.5 -0.979 0 C-N-CA 125.753 1.621 . . . . 0.0 107.361 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -86.31 131.46 34.21 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.713 -1.131 . . . . 0.0 108.683 -178.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.68 122.19 45.56 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -95.21 113.22 24.88 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 101.029 -3.693 . . . . 0.0 101.029 174.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mp -97.41 143.17 13.05 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 -176.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.7 m -126.18 123.5 38.37 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 175.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.3 t-105 -100.85 128.09 47.03 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 104.021 -2.585 . . . . 0.0 104.021 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.426 HD11 HG21 ' A' ' 97' ' ' THR . 7.5 mt -132.27 103.03 6.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 104.27 -2.492 . . . . 0.0 104.27 176.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.43 ' O ' HG12 ' A' ' 89' ' ' VAL . . . -48.7 138.09 15.18 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 176.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -66.62 -7.22 18.93 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.747 -1.443 . . . . 0.0 111.953 -176.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -85.45 -34.78 21.58 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 117.188 -1.387 . . . . 0.0 113.072 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.43 HG12 ' O ' ' A' ' 86' ' ' GLY . 3.2 p -64.39 124.1 18.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 120.941 1.701 . . . . 0.0 109.863 -175.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.8 t -65.82 162.13 19.5 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 122.616 1.198 . . . . 0.0 113.262 -175.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.02 -30.07 72.55 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 125.32 1.438 . . . . 0.0 113.715 -176.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.7 -46.95 87.5 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 118.478 1.139 . . . . 0.0 108.355 175.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -67.48 -41.96 83.71 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 123.171 0.588 . . . . 0.0 109.526 177.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -58.74 -24.95 62.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.739 0.7 . . . . 0.0 110.408 175.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.97 -39.17 93.87 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.061 -1.024 . . . . 0.0 110.531 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.65 -41.53 77.36 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 118.979 0.809 . . . . 0.0 108.849 176.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.426 HG21 HD11 ' A' ' 85' ' ' ILE . 3.4 m -59.1 -30.25 67.97 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.636 -176.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -70.88 -26.38 74.08 Favored Glycine 0 CA--C 1.532 1.128 0 CA-C-N 119.739 1.154 . . . . 0.0 112.448 175.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 33.5 m -89.48 -10.92 44.54 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.425 1.49 . . . . 0.0 109.974 175.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -103.46 -27.82 12.16 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.422 -0.799 . . . . 0.0 111.375 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -53.5 -51.94 61.18 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 119.767 1.167 . . . . 0.0 109.745 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.1 t -58.67 -34.62 71.46 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 123.455 0.702 . . . . 0.0 110.88 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.433 HD11 ' HB ' ' A' ' 6' ' ' THR . 14.8 mt -64.09 -62.39 1.66 Allowed 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 124.014 0.926 . . . . 0.0 110.074 178.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.253 0.9 OUTLIER -60.32 -25.72 34.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 118.481 -1.288 . . . . 0.0 110.224 176.503 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -67.92 -26.41 65.96 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 120.534 1.515 . . . . 0.0 109.729 175.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.68 -25.98 68.45 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.957 1.708 . . . . 0.0 110.729 175.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 79.0 t -86.16 -58.01 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 175.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 60.7 t -73.4 26.32 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 130.358 3.463 . . . . 0.0 111.695 -175.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.43 -26.19 64.97 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 119.814 -1.804 . . . . 0.0 111.261 -176.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -91.94 70.91 5.55 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 175.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.13 175.94 8.94 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.044 0.449 . . . . 0.0 111.001 176.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.85 -66.33 0.94 Allowed 'General case' 0 N--CA 1.439 -1.006 0 N-CA-C 108.696 -0.854 . . . . 0.0 108.696 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.97 175.08 13.44 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 128.343 2.657 . . . . 0.0 107.233 175.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -100.52 178.5 4.71 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 124.509 1.124 . . . . 0.0 112.692 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -143.43 144.54 32.07 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 103.712 -2.699 . . . . 0.0 103.712 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 57.5 t -123.22 131.12 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 175.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -129.64 147.99 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 126.551 1.94 . . . . 0.0 109.335 -175.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.3 p -146.02 9.42 1.13 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.507 1.123 . . . . 0.0 113.08 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -142.51 147.11 35.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -178.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -62.59 -24.22 67.45 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 119.777 1.172 . . . . 0.0 110.213 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -68.34 -55.05 13.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 175.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -56.73 -23.48 42.84 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.706 1.602 . . . . 0.0 111.073 175.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -79.68 -22.84 42.96 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.491 1.916 . . . . 0.0 113.482 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -60.22 124.77 21.29 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 119.488 1.04 . . . . 0.0 112.667 -177.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.406 ' HA ' ' HB ' ' A' ' 128' ' ' ILE . 11.9 mm-40 -58.27 -26.71 63.29 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 176.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -48.71 -66.32 0.42 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.181 1.792 . . . . 0.0 111.182 177.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -78.19 -21.76 49.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 117.077 -1.849 . . . . 0.0 108.768 -176.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.406 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 72.6 mt -55.13 -43.02 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 120.03 1.286 . . . . 0.0 107.793 176.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -54.18 -54.07 44.76 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 119.709 1.14 . . . . 0.0 111.393 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 47.5 t -67.19 -36.28 81.42 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.785 0.721 . . . . 0.0 111.103 -177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -61.7 -48.86 78.85 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.048 1.339 . . . . 0.0 109.402 176.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.68 -36.42 83.78 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.284 177.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -61.54 -55.55 29.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 175.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -56.01 -52.2 65.05 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 127.333 2.253 . . . . 0.0 111.5 -178.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.57 -25.74 67.55 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 121.393 -0.817 . . . . 0.0 111.798 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -84.84 -37.86 9.93 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 125.059 1.314 . . . . 0.0 113.396 -176.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -169.28 178.69 42.31 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-N 119.034 1.417 . . . . 0.0 111.436 -176.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.09 119.14 8.34 Favored 'General case' 0 CA--C 1.527 0.086 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -104.44 105.17 15.19 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -119.57 103.89 9.81 Favored 'General case' 0 N--CA 1.445 -0.681 1 N-CA-C 99.252 -4.351 . . . . 0.0 99.252 175.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -117.52 108.37 15.42 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 103.016 -2.957 . . . . 0.0 103.016 -175.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -131.71 136.66 47.81 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 126.154 1.782 . . . . 0.0 110.26 -175.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -78.22 25.38 0.23 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.458 2.303 . . . . 0.0 111.634 -178.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.2 m 85.83 56.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 128.428 2.691 . . . . 0.0 105.482 -174.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 . . . . . 0 C--O 1.246 0.893 0 C-N-CA 129.463 3.105 . . . . 0.0 104.549 -177.096 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.911 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.0 pt -134.55 -178.4 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 117.929 0.865 . . . . 0.0 110.246 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.27 135.98 56.74 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.43 166.15 34.25 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 127.223 2.209 . . . . 0.0 107.026 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -125.43 43.85 2.96 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 123.203 1.478 . . . . 0.0 110.043 175.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.7 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.4 m -96.27 171.24 8.71 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 127.463 2.305 . . . . 0.0 105.597 175.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.4 tttp -138.85 -170.95 2.97 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 120.787 -1.196 . . . . 0.0 111.268 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -140.2 151.36 21.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 124.342 1.057 . . . . 0.0 111.193 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -95.44 79.05 3.42 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 101.37 -3.567 . . . . 0.0 101.37 174.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -58.63 -33.08 69.64 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 116.569 -1.681 . . . . 0.0 112.188 -175.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -73.54 -54.32 8.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 119.283 0.947 . . . . 0.0 109.199 -176.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.67 -35.5 76.4 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 119.529 -0.272 . . . . 0.0 111.011 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.46 ' HB3' HG11 ' A' ' 107' ' ' VAL . 77.6 m -76.74 -32.3 57.68 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 117.811 -1.09 . . . . 0.0 110.819 175.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.78 -37.96 77.46 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 116.326 -1.797 . . . . 0.0 108.621 177.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.7 -61.62 2.19 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 119.521 1.055 . . . . 0.0 108.966 -177.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.461 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -68.12 -33.82 75.22 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.612 -0.68 . . . . 0.0 111.236 -176.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -59.32 -38.59 80.66 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.417 0.687 . . . . 0.0 110.239 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -66.06 -45.06 82.67 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 124.636 1.175 . . . . 0.0 109.04 178.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -54.69 -57.52 11.17 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 118.716 0.689 . . . . 0.0 109.267 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.6 t -61.07 -24.07 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 123.085 0.554 . . . . 0.0 112.335 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 -45.03 15.52 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 121.177 -0.952 . . . . 0.0 109.474 175.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -51.53 123.33 9.64 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 126.66 1.984 . . . . 0.0 110.943 -175.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -73.41 -9.87 59.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.489 -176.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.46 -8.09 50.24 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-O 118.914 -0.937 . . . . 0.0 112.576 175.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.6 t -68.39 148.03 51.25 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 118.744 1.272 . . . . 0.0 111.176 -175.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.13 -36.03 19.82 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.051 -1.432 . . . . 0.0 107.185 174.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.7 t -68.91 123.89 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -115.91 -24.46 3.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 124.392 1.077 . . . . 0.0 110.642 177.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -121.59 142.45 50.09 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.866 1.266 . . . . 0.0 108.179 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.461 HG21 ' HB1' ' A' ' 16' ' ' ALA . 7.3 t -137.98 160.19 33.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 126.606 1.962 . . . . 0.0 106.652 176.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 76.9 p -126.75 156.87 40.5 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 175.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -129.83 130.94 45.92 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.0 mmmt -103.8 176.1 5.26 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -123.88 139.79 53.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 176.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -131.54 123.3 27.69 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 175.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 47.31 -100.85 0.03 OUTLIER Glycine 0 CA--C 1.525 0.691 0 C-N-CA 124.606 1.098 . . . . 0.0 112.105 -176.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.3 p -120.23 42.72 2.89 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.617 1.167 . . . . 0.0 111.91 177.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.2 t -152.83 160.69 43.1 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.799 1.181 . . . . 0.0 111.4 175.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 21.3 mm -90.79 136.33 24.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 106.087 -1.82 . . . . 0.0 106.087 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.406 ' HB ' ' HD2' ' A' ' 41' ' ' PRO . 3.2 m -131.63 163.58 48.75 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 124.493 1.117 . . . . 0.0 109.976 178.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.406 ' HD2' ' HB ' ' A' ' 40' ' ' VAL . 73.0 Cg_endo -69.97 164.63 34.05 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.017 1.811 . . . . 0.0 111.242 175.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -132.1 -146.92 5.79 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 126.312 1.911 . . . . 0.0 108.856 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.81 161.12 26.89 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 124.878 1.271 . . . . 0.0 110.852 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.27 153.78 36.75 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.307 1.843 . . . . 0.0 110.266 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 174.5 -172.28 45.26 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-N 119.209 0.913 . . . . 0.0 113.279 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.69 -20.47 10.09 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 126.28 1.832 . . . . 0.0 113.002 -176.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -109.18 123.09 48.66 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 -176.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -82.35 -6.62 59.38 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.257 0.623 . . . . 0.0 112.49 -175.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -57.31 -29.29 63.8 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 120.83 -1.169 . . . . 0.0 112.7 177.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -74.6 -36.2 62.97 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.201 1.0 . . . . 0.0 111.239 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -56.76 -40.98 76.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 126.837 2.055 . . . . 0.0 109.087 -176.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.8 mm -55.57 -44.04 74.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 124.043 0.937 . . . . 0.0 108.583 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -85.43 -27.77 25.53 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.229 1.012 . . . . 0.0 111.988 -178.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -63.56 -27.26 69.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 118.323 -0.846 . . . . 0.0 111.259 176.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 75.4 m -60.8 120.45 10.14 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.252 2.1 p -83.96 158.94 21.37 Favored 'General case' 0 N--CA 1.437 -1.078 0 C-N-CA 125.339 1.455 . . . . 0.0 108.992 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -50.41 -73.77 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 126.668 1.987 . . . . 0.0 115.499 -175.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -105.83 -36.49 7.0 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.161 1.385 . . . . 0.0 113.703 -175.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.401 HG13 ' H ' ' A' ' 59' ' ' VAL . 1.8 m -60.8 159.86 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.452 0.701 . . . . 0.0 111.857 -175.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.77 151.04 23.52 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.197 0.599 . . . . 0.0 109.443 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 49.8 tp -150.6 168.04 25.47 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.383 1.473 . . . . 0.0 108.494 -176.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -131.58 154.95 48.32 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.079 0.551 . . . . 0.0 109.688 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -147.36 167.52 24.12 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 123.453 0.701 . . . . 0.0 112.339 176.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -141.09 123.28 15.65 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.8 t -136.12 130.79 48.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.03 114.14 16.61 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 176.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -118.24 170.75 8.63 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 124.36 1.064 . . . . 0.0 108.641 -175.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 89.8 m -136.34 116.76 13.7 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 120.451 -1.406 . . . . 0.0 110.558 -175.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.8 m -151.93 152.61 32.75 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.842 0.857 . . . . 0.0 111.756 179.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.14 172.97 49.59 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 -176.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -139.29 144.24 38.25 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 117.749 0.774 . . . . 0.0 109.943 -175.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.8 -179.14 6.58 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 127.965 2.506 . . . . 0.0 106.024 175.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 96.4 mtp -71.33 -5.64 33.98 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.415 0.686 . . . . 0.0 110.786 175.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.0 m -133.58 170.25 15.8 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 127.913 2.485 . . . . 0.0 107.827 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.9 mtmt -61.46 160.08 11.67 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.4 0.619 . . . . 0.0 110.522 176.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.0 mmt180 -123.48 158.74 30.58 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 175.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.1 t -146.16 137.39 24.6 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 175.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -140.34 123.89 17.08 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -87.89 141.17 28.8 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.5 114.72 23.88 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.085 1.354 . . . . 0.0 109.282 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.33 113.57 21.24 Favored 'General case' 0 C--O 1.225 -0.237 0 N-CA-C 103.664 -2.717 . . . . 0.0 103.664 175.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.2 mt -105.31 142.66 17.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 m -126.27 123.57 38.4 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 175.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.7 t-105 -90.29 123.44 34.06 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 103.798 -2.668 . . . . 0.0 103.798 175.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 4.7 mm -137.56 86.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 103.563 -2.754 . . . . 0.0 103.563 176.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.76 147.36 6.89 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -178.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -54.29 -21.82 10.28 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.897 0.702 . . . . 0.0 112.897 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -83.12 -34.76 26.01 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 117.321 -1.323 . . . . 0.0 112.078 -175.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.82 136.09 26.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 120.489 1.495 . . . . 0.0 109.88 -178.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.7 t -145.82 176.71 9.46 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 127.125 2.17 . . . . 0.0 107.396 -176.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.72 -156.81 53.52 Favored Glycine 0 N--CA 1.45 -0.405 0 CA-C-O 121.535 0.519 . . . . 0.0 112.148 175.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 tt -51.63 -36.78 47.39 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.799 1.24 . . . . 0.0 111.269 -176.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.4 mp0 -63.7 -35.68 81.35 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 119.565 1.075 . . . . 0.0 112.141 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -76.06 -49.72 16.71 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 175.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.22 -29.21 63.55 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.299 1.44 . . . . 0.0 113.296 -175.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 23.0 mttt -48.47 -37.74 18.19 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 119.778 1.172 . . . . 0.0 111.415 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 20.3 m -58.16 -32.28 68.04 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.889 0.768 . . . . 0.0 111.893 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.24 -25.97 72.46 Favored Glycine 0 CA--C 1.53 0.985 0 O-C-N 120.86 -1.15 . . . . 0.0 112.34 177.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.5 m -105.75 -16.69 14.6 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 126.489 1.915 . . . . 0.0 111.633 -176.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -103.95 -25.85 12.87 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 126.086 1.754 . . . . 0.0 112.073 -175.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 19.3 mtmt -56.67 -26.65 56.96 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.453 1.479 . . . . 0.0 112.311 175.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -62.3 -38.31 88.88 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 118.942 0.792 . . . . 0.0 109.84 176.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.7 HD11 ' HB ' ' A' ' 6' ' ' THR . 39.6 mt -68.88 -61.41 1.81 Allowed 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 125.849 1.66 . . . . 0.0 109.576 -176.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.286 1.4 p -55.89 -30.87 29.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 118.052 -0.975 . . . . 0.0 108.514 176.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.55 -39.06 93.43 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 120.626 1.557 . . . . 0.0 109.617 175.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -54.95 -29.04 55.66 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 121.487 1.949 . . . . 0.0 111.701 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.46 HG11 ' HB3' ' A' ' 13' ' ' CYS . 79.7 t -86.1 -52.35 12.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 119.258 0.935 . . . . 0.0 109.227 175.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 92.2 t -79.21 14.82 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 129.432 3.093 . . . . 0.0 115.116 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -55.72 -26.21 44.17 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 122.381 2.355 . . . . 0.0 112.866 -176.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -84.85 63.7 8.19 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 175.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -137.47 176.4 8.74 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.674 0.789 . . . . 0.0 109.52 176.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -105.93 -66.38 1.0 Allowed 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 124.096 0.873 . . . . 0.0 110.216 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -148.26 176.21 10.44 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.818 1.647 . . . . 0.0 109.614 -176.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -121.37 171.94 8.4 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 125.021 1.328 . . . . 0.0 111.467 -177.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -145.61 147.98 32.62 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 17.2 t -126.32 125.68 67.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 175.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.3 mt -121.79 143.93 32.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 125.979 1.712 . . . . 0.0 109.214 -175.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.9 p -137.42 1.39 2.39 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -142.87 153.43 43.14 Favored 'General case' 0 C--O 1.231 0.128 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -177.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -62.52 -38.74 91.14 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.719 0.69 . . . . 0.0 110.237 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -61.47 -45.28 94.94 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 119.091 0.859 . . . . 0.0 109.232 175.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -62.47 -23.94 67.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.813 1.245 . . . . 0.0 111.011 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -83.68 -23.86 31.54 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.074 1.75 . . . . 0.0 113.02 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -62.65 124.07 20.02 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.75 0.705 . . . . 0.0 112.127 -175.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.71 -26.07 66.88 Favored 'General case' 0 CA--C 1.527 0.077 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -56.7 -45.18 81.98 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -175.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -89.61 -24.42 21.68 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 117.961 -1.019 . . . . 0.0 109.102 178.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 24.8 mt -56.68 -40.92 72.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 N-CA-C 106.65 -1.611 . . . . 0.0 106.65 175.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.3 mtpm? -53.59 -52.46 59.72 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 118.593 0.633 . . . . 0.0 110.215 175.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 9.2 t -65.64 -37.94 87.96 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.468 0.707 . . . . 0.0 111.108 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -61.4 -53.88 50.82 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.85 1.66 . . . . 0.0 108.934 177.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 76.2 mt -62.0 -34.18 75.71 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 125.103 1.361 . . . . 0.0 110.098 175.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.03 -50.25 74.1 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 120.434 1.47 . . . . 0.0 110.643 175.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt -62.01 -49.65 75.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 120.352 1.433 . . . . 0.0 109.08 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -76.08 16.77 0.4 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.227 1.011 . . . . 0.0 111.988 175.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -69.74 -8.05 59.79 Favored Glycine 0 C--N 1.335 0.483 0 C-N-CA 125.971 1.748 . . . . 0.0 116.115 -174.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 63.59 62.04 5.68 Favored Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 107.589 -2.204 . . . . 0.0 107.589 -175.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.54 161.46 1.44 Allowed 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.783 0.833 . . . . 0.0 110.398 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -119.96 132.19 55.43 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -126.34 99.02 5.67 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 101.737 -3.431 . . . . 0.0 101.737 177.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -134.35 159.18 41.84 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.381 1.073 . . . . 0.0 110.553 -175.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -146.33 136.29 23.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.524 1.53 . . . . 0.0 107.125 177.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -140.66 151.64 44.74 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 104.999 -2.222 . . . . 0.0 104.999 176.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.7 m 85.72 56.56 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.78 2.032 . . . . 0.0 105.833 -175.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 . . . . . 0 C--O 1.257 1.487 0 N-CA-C 103.915 -2.624 . . . . 0.0 103.915 175.859 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.904 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 16.8 tt -53.55 112.76 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 122.608 1.194 . . . . 0.0 112.211 -156.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.37 156.48 42.13 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 129.058 2.943 . . . . 0.0 105.17 176.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 22.9 ttp -129.57 173.87 10.19 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 105.275 -2.12 . . . . 0.0 105.275 175.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -71.64 82.18 0.85 Allowed 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 175.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.6 m -63.56 157.72 22.97 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.005 1.722 . . . . 0.0 106.644 176.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.96 -173.04 2.66 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 120.668 -1.27 . . . . 0.0 112.021 -175.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.66 149.26 29.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 124.005 0.922 . . . . 0.0 109.413 177.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -94.6 71.08 3.61 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 103.554 -2.758 . . . . 0.0 103.554 175.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -56.67 -34.09 67.03 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-O 117.909 -1.044 . . . . 0.0 111.517 -175.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -70.09 -38.67 75.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 119.828 1.194 . . . . 0.0 110.615 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.81 -49.32 18.41 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 121.827 -0.546 . . . . 0.0 110.057 175.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.3 m -62.1 -38.02 87.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.699 -0.626 . . . . 0.0 111.56 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -62.49 -31.59 72.37 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 116.289 -1.815 . . . . 0.0 110.327 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.38 -54.38 47.48 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 120.766 1.621 . . . . 0.0 110.727 178.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.492 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -70.59 -40.06 73.47 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.516 -0.74 . . . . 0.0 111.486 -178.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -55.66 -43.01 75.9 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 118.406 -0.807 . . . . 0.0 109.683 176.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -57.54 -45.0 85.61 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.487 1.115 . . . . 0.0 111.043 -177.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mp -59.45 -63.04 1.44 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.324 0.65 . . . . 0.0 110.099 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.5 t -58.35 -30.56 40.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 123.108 0.563 . . . . 0.0 111.84 -176.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.24 -28.2 63.0 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.894 1.277 . . . . 0.0 111.342 175.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -71.18 155.73 40.4 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.682 0.673 . . . . 0.0 109.7 -174.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -86.43 -18.5 31.57 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.954 1.302 . . . . 0.0 113.297 177.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -106.29 -2.43 38.38 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 125.155 1.359 . . . . 0.0 114.586 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.3 t -69.66 135.34 49.77 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 119.574 1.687 . . . . 0.0 110.407 -178.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.74 -25.52 56.63 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 175.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 55.2 t -78.27 123.9 35.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.385 -2.08 . . . . 0.0 105.385 175.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.2 pp -112.66 -23.7 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.673 1.189 . . . . 0.0 111.155 -176.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 38.2 p-90 -130.05 153.69 48.19 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 122.013 0.911 . . . . 0.0 111.008 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.492 HG21 ' HB1' ' A' ' 16' ' ' ALA . 5.2 t -139.6 165.89 21.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 128.579 2.752 . . . . 0.0 108.622 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 30.9 p -126.0 160.86 28.92 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.487 1.115 . . . . 0.0 109.0 175.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -132.86 126.67 32.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.8 mmmt -109.44 171.5 7.41 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 104.579 -2.378 . . . . 0.0 104.579 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.421 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 49.6 m-85 -121.65 143.68 49.2 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 175.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -139.19 123.54 18.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 35.43 -98.98 0.01 OUTLIER Glycine 0 CA--C 1.532 1.099 0 C-N-CA 126.916 2.198 . . . . 0.0 115.068 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 m -104.4 18.3 22.43 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.253 1.421 . . . . 0.0 113.941 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.2 t -146.37 169.0 19.75 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 120.748 1.613 . . . . 0.0 114.166 -175.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.421 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 17.5 mm -99.21 132.96 43.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 104.39 -2.448 . . . . 0.0 104.39 175.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.3 m -126.16 154.96 74.34 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 175.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.75 162.87 36.85 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 CA-C-N 121.357 1.52 . . . . 0.0 109.565 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -121.5 -158.63 10.43 Favored Glycine 0 CA--C 1.523 0.575 0 C-N-CA 126.517 2.008 . . . . 0.0 108.69 175.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -60.23 167.59 2.35 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 122.073 0.939 . . . . 0.0 112.694 176.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -138.0 161.64 36.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.752 2.021 . . . . 0.0 110.271 -175.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.42 176.74 43.93 Favored Glycine 0 CA--C 1.527 0.785 0 CA-C-O 122.029 0.794 . . . . 0.0 113.346 178.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -125.77 -3.46 7.15 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.494 1.918 . . . . 0.0 112.042 -176.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -131.22 127.78 38.6 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 127.27 2.228 . . . . 0.0 105.889 -175.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -83.17 -15.85 48.97 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 118.357 -0.83 . . . . 0.0 109.407 -175.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -55.82 -36.31 67.34 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 120.139 1.336 . . . . 0.0 109.595 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -65.63 -29.27 69.82 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 118.406 -0.806 . . . . 0.0 112.015 176.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.426 ' CD1' HD11 ' A' ' 123' ' ' LEU . 1.0 OUTLIER -61.27 -51.67 67.93 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 124.42 1.088 . . . . 0.0 108.936 178.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.8 mp -62.75 -34.7 67.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 O-C-N 121.665 -0.647 . . . . 0.0 109.648 -175.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -73.92 -35.0 64.56 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.131 0.878 . . . . 0.0 111.226 176.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -61.93 -33.42 74.23 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.939 1.296 . . . . 0.0 112.893 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 89.9 m -50.64 121.49 5.89 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.077 0.951 . . . . 0.0 110.337 -176.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 p -84.15 170.69 13.55 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 128.532 2.733 . . . . 0.0 111.798 -176.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' A' ' 58' ' ' ASP . 10.2 p-10 -69.9 -76.87 0.09 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.942 2.097 . . . . 0.0 115.957 -174.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.423 ' H ' ' CG ' ' A' ' 57' ' ' ASP . 3.2 t70 -106.51 -30.57 8.98 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 127.106 2.162 . . . . 0.0 112.402 -176.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.5 m -55.18 156.24 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-O 122.966 1.365 . . . . 0.0 111.451 -175.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.0 123.81 48.72 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 176.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.5 tp -129.29 165.98 20.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.628 1.571 . . . . 0.0 109.317 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -132.01 152.25 51.25 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.484 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -138.01 155.05 49.24 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.009 1.324 . . . . 0.0 111.268 177.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -127.9 123.49 35.12 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.956 -2.239 . . . . 0.0 104.956 177.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.1 t -132.5 135.77 57.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -80.48 123.69 28.28 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 175.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -126.25 169.88 12.43 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.929 1.292 . . . . 0.0 108.029 -176.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.0 m -136.05 113.36 10.66 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 120.162 -1.586 . . . . 0.0 108.683 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.8 m -156.38 151.6 26.51 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.75 1.62 . . . . 0.0 106.633 175.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 113.06 113.27 3.17 Favored Glycine 0 N--CA 1.441 -0.995 0 N-CA-C 103.296 -3.922 . . . . 0.0 103.296 -175.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -89.97 113.88 25.61 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 111.942 -2.129 . . . . 0.0 106.449 -175.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.57 176.72 9.61 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.248 1.019 . . . . 0.0 110.363 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 69.4 mtm -66.35 -5.77 11.9 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.574 1.55 . . . . 0.0 113.397 176.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.3 m -146.33 170.64 16.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 119.998 -1.689 . . . . 0.0 108.795 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -61.56 151.41 33.23 Favored 'General case' 0 C--N 1.339 0.136 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 177.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -137.47 161.97 34.92 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 103.796 -2.668 . . . . 0.0 103.796 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.1 t -142.05 149.14 39.55 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 176.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -131.15 172.38 12.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -141.69 139.67 33.0 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 177.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -116.47 117.58 30.3 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 -176.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.421 HD22 ' O ' ' A' ' 63' ' ' ALA . 1.7 tm? -91.47 113.64 25.96 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 102.138 -3.282 . . . . 0.0 102.138 175.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.3 mp -105.75 125.73 61.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -101.84 123.51 45.9 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 56.0 t-105 -95.33 123.41 38.84 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 104.729 -2.323 . . . . 0.0 104.729 175.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.3 mt -143.92 98.36 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 -179.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -63.32 166.79 24.69 Favored Glycine 0 CA--C 1.534 1.226 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 175.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -77.97 -12.01 59.95 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.344 -1.68 . . . . 0.0 110.628 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -83.07 -27.43 30.27 Favored 'General case' 0 C--O 1.237 0.426 0 O-C-N 120.14 -1.6 . . . . 0.0 112.17 -175.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.3 p -67.43 123.85 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 104.75 -2.315 . . . . 0.0 104.75 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.7 t -66.23 158.73 28.13 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 122.203 1.001 . . . . 0.0 111.4 -175.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -56.92 -24.43 49.81 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.411 1.482 . . . . 0.0 113.196 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 9.8 tt -67.99 -50.79 53.5 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-N 119.354 1.577 . . . . 0.0 109.641 176.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -63.96 -43.65 95.16 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 176.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 42.3 ttp85 -55.09 -35.81 64.98 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 118.391 0.541 . . . . 0.0 111.249 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.63 -26.62 65.63 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 118.025 -0.988 . . . . 0.0 111.888 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -57.15 -39.47 75.27 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 121.115 1.78 . . . . 0.0 111.371 175.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 38.1 m -55.5 -28.22 53.31 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 119.948 1.249 . . . . 0.0 110.99 175.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.44 -20.58 67.84 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.409 1.481 . . . . 0.0 114.406 176.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 92.4 m -120.9 -6.96 9.55 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.909 1.284 . . . . 0.0 110.89 176.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -104.19 -24.96 13.1 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-O 118.247 -0.882 . . . . 0.0 113.169 -175.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -58.63 -24.04 60.28 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 121.248 1.84 . . . . 0.0 111.434 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -69.65 -41.25 75.82 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 120.197 1.362 . . . . 0.0 108.608 175.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 25.4 mt -57.5 -63.04 1.37 Allowed 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 126.193 1.797 . . . . 0.0 111.408 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.429 HG12 ' H ' ' A' ' 104' ' ' VAL . 0.9 OUTLIER -59.53 -29.65 42.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.059 176.142 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -72.14 -25.06 61.56 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-O 116.882 -1.532 . . . . 0.0 111.714 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -61.64 -38.53 88.03 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 122.061 2.209 . . . . 0.0 109.713 175.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 98.9 t -72.97 -60.37 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 175.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 39.3 t -77.79 26.45 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 129.153 2.981 . . . . 0.0 112.927 -175.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -57.19 -26.36 60.51 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 119.713 -1.867 . . . . 0.0 110.751 -177.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -84.3 72.49 10.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.92 1.288 . . . . 0.0 107.854 175.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -145.03 174.63 10.87 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 122.826 0.45 . . . . 0.0 110.878 176.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.35 -66.2 0.93 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 118.507 -0.759 . . . . 0.0 109.865 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.38 176.41 11.71 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.702 2.001 . . . . 0.0 108.721 178.095 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -106.4 173.5 6.29 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 123.568 0.747 . . . . 0.0 112.204 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.47 ' CD1' HD11 ' A' ' 117' ' ' ILE . 0.7 OUTLIER -143.4 155.04 44.29 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 103.126 -2.916 . . . . 0.0 103.126 -179.9 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 14.7 t -131.84 129.52 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 O-C-N 120.61 -1.306 . . . . 0.0 107.679 175.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.47 HD11 ' CD1' ' A' ' 115' ' ' PHE . 2.6 mp -133.97 148.1 30.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 125.509 1.524 . . . . 0.0 107.835 -178.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 7.7 p -130.85 -8.45 3.97 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.454 1.902 . . . . 0.0 113.966 -176.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -124.22 124.27 42.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -176.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.9 ttp85 -60.17 -30.56 69.41 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.316 -178.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -74.66 -26.18 59.69 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 119.83 1.195 . . . . 0.0 111.909 175.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.31 -40.54 43.95 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -177.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.426 HD11 ' CD1' ' A' ' 51' ' ' PHE . 2.3 tm? -45.18 -23.32 0.16 Allowed 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 130.195 3.398 . . . . 0.0 116.279 -175.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -48.15 130.54 15.88 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 125.476 1.51 . . . . 0.0 111.782 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -56.12 -16.48 5.19 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 176.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.262 30.2 t70 -58.1 -56.42 22.31 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 117.565 -1.207 . . . . 0.0 112.988 -175.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -77.09 -26.36 53.32 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 116.459 -2.096 . . . . 0.0 107.608 -175.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 51.4 mt -55.72 -40.84 62.77 Favored 'Isoleucine or valine' 0 C--N 1.343 0.302 0 C-N-CA 124.836 1.254 . . . . 0.0 108.331 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.2 mtmm -54.35 -52.17 62.43 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.915 0.779 . . . . 0.0 110.438 175.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 47.5 t -63.93 -44.25 93.43 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 117.962 -1.018 . . . . 0.0 109.47 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -63.85 -40.54 96.82 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.731 1.605 . . . . 0.0 110.687 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.44 -32.68 74.42 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.754 0.821 . . . . 0.0 109.358 175.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 46.3 mmtt -76.31 -38.53 55.9 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 125.412 1.485 . . . . 0.0 112.083 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -59.86 -57.24 13.73 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 125.998 1.719 . . . . 0.0 106.79 175.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.73 -3.38 21.62 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.461 0.705 . . . . 0.0 112.582 175.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -93.19 -54.85 1.66 Allowed Glycine 0 C--N 1.333 0.371 0 C-N-CA 125.056 1.312 . . . . 0.0 111.121 -176.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 65.82 178.1 7.76 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 122.16 0.867 . . . . 0.0 111.212 -175.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -153.06 85.83 1.23 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -144.38 121.44 11.42 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -136.31 84.56 2.08 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 104.5 -2.407 . . . . 0.0 104.5 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -156.0 136.32 13.07 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 127.592 2.357 . . . . 0.0 107.354 -175.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.03 93.25 1.42 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.985 1.314 . . . . 0.0 108.582 176.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -93.51 62.47 3.34 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.446 -0.784 . . . . 0.0 109.615 -176.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 m 84.5 56.14 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 127.52 2.328 . . . . 0.0 106.012 -175.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.224 1.81 . . . . 0.0 107.912 -175.735 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.912 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 29.1 mt -131.72 155.76 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 168.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -122.72 109.18 13.92 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 103.62 -2.733 . . . . 0.0 103.62 175.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.55 176.18 5.24 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.062 0.945 . . . . 0.0 110.043 -175.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -75.79 52.25 0.67 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.665 1.586 . . . . 0.0 111.533 177.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.634 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.8 m -111.9 171.92 7.21 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 128.06 2.544 . . . . 0.0 106.298 176.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.7 mmtp -140.48 178.99 6.92 Favored 'General case' 0 CA--C 1.513 -0.446 0 O-C-N 121.219 -0.926 . . . . 0.0 111.332 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.401 ' H ' HD13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -126.23 150.49 31.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 124.58 1.152 . . . . 0.0 109.441 179.243 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -95.05 83.42 3.93 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 101.759 -3.423 . . . . 0.0 101.759 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -61.99 -29.36 70.2 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 117.324 -1.322 . . . . 0.0 112.93 -175.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -69.09 -59.22 3.18 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.629 1.104 . . . . 0.0 108.346 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.62 95.68 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 122.667 0.387 . . . . 0.0 111.276 -176.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 85.7 m -73.97 -33.21 63.79 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 118.56 -0.733 . . . . 0.0 110.781 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.7 ttt-85 -63.92 -37.1 86.17 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 116.979 -1.486 . . . . 0.0 108.53 175.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.75 -46.91 87.71 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 120.351 1.432 . . . . 0.0 110.679 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.469 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -61.26 -50.78 71.67 Favored 'General case' 0 N--CA 1.462 0.137 0 O-C-N 121.553 -0.717 . . . . 0.0 111.523 176.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -51.39 -47.53 62.87 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.581 0.752 . . . . 0.0 110.293 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.89 -49.55 77.24 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.417 1.887 . . . . 0.0 111.0 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mp -59.52 -51.14 71.14 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 120.275 1.398 . . . . 0.0 111.205 175.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.415 ' CG2' HG23 ' A' ' 30' ' ' VAL . 79.2 t -60.93 -30.4 47.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 O-C-N 121.741 -0.599 . . . . 0.0 110.033 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.15 -38.74 60.87 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.375 1.07 . . . . 0.0 112.973 175.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -67.46 123.36 20.18 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -175.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.67 -32.16 68.85 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 124.666 1.186 . . . . 0.0 112.205 176.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.0 -11.47 82.51 Favored Glycine 0 CA--C 1.526 0.757 0 CA-C-O 119.374 -0.681 . . . . 0.0 112.45 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.0 t -81.19 123.62 28.6 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 118.961 1.381 . . . . 0.0 107.552 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.48 -23.89 62.77 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.608 175.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.0 t -67.23 123.69 20.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -108.32 -23.78 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 C-N-CA 124.315 1.046 . . . . 0.0 110.06 178.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.422 ' HB2' HG22 ' A' ' 65' ' ' VAL . 10.5 p-90 -131.05 138.99 49.86 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.802 0.841 . . . . 0.0 110.502 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.469 HG11 ' HB1' ' A' ' 16' ' ' ALA . 62.0 t -136.34 149.96 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 175.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.465 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 23.3 p -104.34 159.76 15.45 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 176.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -124.45 123.82 40.97 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 175.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -98.45 175.78 5.91 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 176.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -127.03 124.05 38.45 Favored 'General case' 0 N--CA 1.444 -0.767 0 N-CA-C 106.781 -1.562 . . . . 0.0 106.781 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -112.69 123.42 50.27 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 104.261 -2.496 . . . . 0.0 104.261 175.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 23.04 -88.86 0.01 OUTLIER Glycine 0 CA--C 1.529 0.961 0 C-N-CA 127.661 2.553 . . . . 0.0 116.683 -176.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 65.0 p -92.66 2.22 56.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.059 2.143 . . . . 0.0 116.175 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -150.63 175.83 11.57 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.233 1.379 . . . . 0.0 114.647 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 11.6 mm -93.69 136.26 25.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 128.036 2.534 . . . . 0.0 106.256 175.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.8 m -135.31 159.36 72.09 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-O 118.475 -0.774 . . . . 0.0 110.561 176.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.12 155.46 47.24 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 121.753 1.635 . . . . 0.0 110.288 175.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -120.45 -152.86 9.0 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 126.668 2.08 . . . . 0.0 109.728 176.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.42 164.97 5.11 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.491 1.117 . . . . 0.0 110.736 176.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -145.03 162.29 37.31 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.252 1.421 . . . . 0.0 110.127 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -168.72 176.7 42.91 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-O 122.055 0.809 . . . . 0.0 112.512 -179.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -125.46 -6.07 7.04 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.049 1.739 . . . . 0.0 111.965 -176.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.23 141.9 43.99 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 -177.17 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -83.89 -14.52 50.87 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -174.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -60.56 -36.11 77.68 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 119.885 -1.76 . . . . 0.0 109.564 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -71.7 -22.76 61.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.323 1.049 . . . . 0.0 112.034 175.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -67.09 -43.57 82.2 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.339 1.056 . . . . 0.0 109.522 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.0 mm -54.32 -47.24 69.3 Favored 'Isoleucine or valine' 0 C--N 1.342 0.245 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 -176.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.3 mm-40 -65.03 -23.93 67.34 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.53 0.732 . . . . 0.0 112.502 -176.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -77.39 -24.26 50.56 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 119.444 1.02 . . . . 0.0 111.359 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.2 m -73.83 113.62 11.19 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.07 -1.455 . . . . 0.0 107.07 177.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.31 2.1 p -100.73 178.39 4.72 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.892 1.277 . . . . 0.0 110.594 -176.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -70.09 -76.15 0.1 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 117.951 2.574 . . . . 0.0 117.951 -174.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -90.39 -27.8 19.09 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 120.226 1.375 . . . . 0.0 114.569 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.7 m -70.63 169.66 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 O-C-N 120.895 -1.128 . . . . 0.0 112.165 -175.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.441 ' HD3' ' H ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -121.3 144.77 48.45 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.805 1.242 . . . . 0.0 107.986 178.059 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 59.9 tp -146.79 166.63 26.06 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.058 1.743 . . . . 0.0 107.702 -176.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -133.08 157.82 44.31 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 176.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.71 153.51 41.06 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 118.744 0.702 . . . . 0.0 111.139 175.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.403 ' CE1' ' HB3' ' A' ' 79' ' ' PHE . 54.7 t80 -119.86 123.64 44.12 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 104.536 -2.394 . . . . 0.0 104.536 175.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.422 HG22 ' HB2' ' A' ' 29' ' ' TRP . 39.3 t -135.15 138.72 48.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 O-C-N 123.222 0.326 . . . . 0.0 110.209 -175.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.7 ttm180 -75.41 117.85 17.65 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.639 1.976 . . . . 0.0 106.949 175.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -131.88 150.92 52.01 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -175.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 84.7 m -111.69 113.3 25.59 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 121.517 -0.74 . . . . 0.0 111.153 -175.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.8 m -156.69 130.69 8.43 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 175.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.34 151.14 5.64 Favored Glycine 0 CA--C 1.519 0.307 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 176.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -124.4 124.57 42.63 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 -175.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.8 179.56 7.49 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.504 1.922 . . . . 0.0 107.161 175.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 60.8 mtm -65.97 -6.84 13.92 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.501 0.591 . . . . 0.0 111.713 175.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.2 m -146.0 176.43 9.71 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.955 2.102 . . . . 0.0 109.845 -175.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.416 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 2.4 mptp? -55.78 143.35 31.34 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.379 0.671 . . . . 0.0 109.585 177.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -119.38 162.46 18.76 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 t -139.55 151.73 46.32 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.3 mttp -146.39 175.81 10.26 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.686 1.995 . . . . 0.0 107.076 176.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.403 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . 92.1 m-85 -140.26 134.69 31.4 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 175.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -104.83 114.26 28.36 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 124.877 1.361 . . . . 0.0 107.401 177.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -83.47 113.53 20.84 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 102.339 -3.208 . . . . 0.0 102.339 175.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 mt -96.75 142.66 13.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 -176.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.3 m -125.59 123.46 39.08 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 104.382 -2.451 . . . . 0.0 104.382 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 39.5 t-105 -103.06 124.28 48.24 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 104.825 -2.287 . . . . 0.0 104.825 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.5 mm -125.54 110.06 23.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 103.562 -2.755 . . . . 0.0 103.562 175.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.441 ' O ' HG12 ' A' ' 89' ' ' VAL . . . -54.96 126.8 39.54 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 107.643 -2.183 . . . . 0.0 107.643 175.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.53 -12.25 2.58 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 118.786 1.293 . . . . 0.0 112.833 -175.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -83.77 -30.68 26.43 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 117.324 -1.322 . . . . 0.0 111.401 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.441 HG12 ' O ' ' A' ' 86' ' ' GLY . 8.4 p -74.14 143.82 13.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 121.083 1.765 . . . . 0.0 111.392 -175.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.0 t -143.16 176.69 8.93 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.463 1.905 . . . . 0.0 106.938 175.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 79.58 -156.32 40.65 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 176.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.0 tt -59.27 -42.52 91.41 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.404 1.081 . . . . 0.0 112.535 -175.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -33.62 73.86 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 120.706 1.594 . . . . 0.0 111.536 -176.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.31 -50.33 27.83 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 175.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.34 -27.02 67.03 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 125.17 1.388 . . . . 0.0 113.41 -176.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.8 mttt -46.26 -41.32 12.85 Favored 'General case' 0 CA--C 1.502 -0.889 0 C-N-CA 124.489 1.116 . . . . 0.0 110.205 175.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.2 m -52.79 -39.6 62.47 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.422 1.089 . . . . 0.0 111.144 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -74.86 -10.31 83.59 Favored Glycine 0 CA--C 1.532 1.146 0 O-C-N 121.351 -0.843 . . . . 0.0 113.612 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 47.2 m -112.46 -15.14 13.15 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.358 1.863 . . . . 0.0 110.763 177.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -104.31 -29.33 10.85 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 126.504 1.921 . . . . 0.0 112.898 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -54.41 -33.04 58.59 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 119.901 1.228 . . . . 0.0 112.885 177.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.8 t -63.95 -34.19 77.43 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 118.842 0.746 . . . . 0.0 111.412 176.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.634 HD11 ' HB ' ' A' ' 6' ' ' THR . 30.8 mt -67.76 -61.82 1.7 Allowed 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 125.678 1.591 . . . . 0.0 109.478 -175.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -58.67 -33.33 48.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-O 118.147 -0.93 . . . . 0.0 109.173 175.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 63.0 tttt -64.92 -42.07 95.03 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 120.481 1.491 . . . . 0.0 110.232 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.78 -26.06 61.4 Favored 'General case' 0 C--N 1.335 -0.048 0 CA-C-N 119.146 0.885 . . . . 0.0 111.952 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 69.7 t -84.27 -61.74 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 175.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.05 26.53 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 129.843 3.257 . . . . 0.0 113.448 -175.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -50.54 -26.78 5.61 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 119.895 -1.753 . . . . 0.0 112.491 -176.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -88.75 74.49 8.33 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 175.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -140.04 161.0 38.66 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 104.942 -2.244 . . . . 0.0 104.942 175.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -87.49 -66.83 0.87 Allowed 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.201 -176.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.99 176.34 12.32 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 129.615 3.166 . . . . 0.0 108.698 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -119.89 165.73 14.24 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.345 1.058 . . . . 0.0 112.74 -175.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -133.94 147.31 51.05 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 104.311 -2.478 . . . . 0.0 104.311 -175.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.8 t -123.14 129.52 74.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 176.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -132.9 141.14 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 125.26 1.424 . . . . 0.0 107.752 -176.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 p -139.38 -2.26 1.63 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 175.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -129.07 151.35 49.85 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 124.512 1.125 . . . . 0.0 110.182 178.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 40.8 ttp-105 -58.19 -45.43 87.59 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 123.103 0.561 . . . . 0.0 110.881 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -65.66 -23.48 66.8 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.65 0.659 . . . . 0.0 110.539 -176.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -83.37 -23.25 32.53 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.9 2.08 . . . . 0.0 110.986 175.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -77.35 -23.29 50.9 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.692 1.597 . . . . 0.0 112.536 178.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 -63.4 123.78 19.59 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -175.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -49.69 -25.25 2.77 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 119.28 3.067 . . . . 0.0 119.28 175.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -63.33 -56.26 17.83 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 119.335 0.971 . . . . 0.0 113.154 -175.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -78.37 -26.09 46.52 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 118.0 -1.48 . . . . 0.0 109.152 -177.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 19.4 mt -52.7 -40.5 34.81 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 C-N-CA 124.899 1.28 . . . . 0.0 108.926 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 33.8 mttp -54.8 -49.49 70.84 Favored 'General case' 0 N--CA 1.457 -0.075 0 CA-C-N 118.213 0.46 . . . . 0.0 111.766 176.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 35.1 t -72.0 -36.31 69.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.059 0.544 . . . . 0.0 111.379 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.15 -46.03 91.05 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 119.466 1.03 . . . . 0.0 108.603 176.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 74.1 mt -66.6 -23.92 66.25 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 123.849 0.86 . . . . 0.0 110.883 175.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 16.1 mttt -73.0 -47.81 41.88 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 120.413 1.461 . . . . 0.0 107.182 175.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -61.44 -60.78 3.19 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.716 0.806 . . . . 0.0 109.036 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.37 1.22 1.71 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.087 1.355 . . . . 0.0 112.124 175.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -38.76 106.5 0.05 OUTLIER Glycine 0 C--N 1.337 0.619 0 C-N-CA 128.368 2.89 . . . . 0.0 111.962 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -66.26 102.46 0.73 Allowed Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 106.668 -2.573 . . . . 0.0 106.668 175.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.03 144.68 18.63 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 -179.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -144.25 122.82 12.48 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 -176.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -134.66 97.08 3.69 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 105.253 -2.128 . . . . 0.0 105.253 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -146.67 88.48 1.77 Allowed 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.472 -1.24 . . . . 0.0 107.825 -175.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -101.05 95.13 6.37 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.741 1.216 . . . . 0.0 110.202 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -149.12 77.33 1.36 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.006 1.323 . . . . 0.0 108.456 175.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 4.8 m 60.53 56.03 3.22 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.547 1.139 . . . . 0.0 109.662 -178.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 125.825 1.65 . . . . 0.0 109.855 178.434 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.761 0 N-CA-C 110.466 -1.054 . . . . 0.0 110.466 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.4 tt -74.3 33.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 C-N-CA 124.793 1.237 . . . . 0.0 112.546 -174.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 67.7 mtt85 -135.93 119.1 16.56 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 127.397 2.279 . . . . 0.0 106.518 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 91.4 mtp -77.49 23.56 0.22 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.439 1.095 . . . . 0.0 111.186 176.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.75 62.64 7.51 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 125.598 1.559 . . . . 0.0 108.028 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.9 m -142.99 158.27 43.76 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.608 1.563 . . . . 0.0 106.962 -175.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -132.66 -171.73 2.73 Favored 'General case' 0 CA--C 1.518 -0.282 0 O-C-N 121.273 -0.892 . . . . 0.0 111.92 -175.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.9 152.9 33.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 C-N-CA 124.388 1.075 . . . . 0.0 110.913 176.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -99.78 85.0 3.0 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 100.601 -3.851 . . . . 0.0 100.601 174.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -61.24 -24.3 66.27 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 117.166 -1.397 . . . . 0.0 112.54 -175.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -76.95 -54.18 6.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 120.786 1.63 . . . . 0.0 109.205 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.11 -36.33 83.23 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.768 -0.583 . . . . 0.0 111.043 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 79.5 m -75.56 -38.84 58.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 118.966 -0.54 . . . . 0.0 111.526 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.7 ttt-85 -60.06 -34.53 73.55 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-O 116.789 -1.577 . . . . 0.0 109.024 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.87 -56.6 18.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 120.596 1.544 . . . . 0.0 110.509 -177.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.656 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -61.42 -43.69 98.44 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 118.507 0.594 . . . . 0.0 111.751 179.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -55.24 -44.19 75.27 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -59.51 -41.95 91.11 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.327 1.451 . . . . 0.0 111.105 -176.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.37 -60.99 2.77 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 123.984 0.802 . . . . 0.0 109.88 175.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.498 ' CG2' HG23 ' A' ' 30' ' ' VAL . 71.0 t -59.06 -31.64 46.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 122.978 0.511 . . . . 0.0 111.58 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -37.25 86.92 Favored 'General case' 0 CA--C 1.521 -0.166 0 C-N-CA 125.872 1.669 . . . . 0.0 110.769 176.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -81.59 123.21 28.48 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 124.013 0.821 . . . . 0.0 109.68 -176.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.13 -17.87 64.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 118.596 -0.716 . . . . 0.0 112.884 175.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -82.28 -12.44 80.67 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.737 1.16 . . . . 0.0 113.061 176.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.1 t -80.06 137.9 36.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 119.559 1.68 . . . . 0.0 109.038 -177.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -74.34 -18.59 60.67 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.233 175.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.0 t -82.45 123.83 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 106.495 -1.668 . . . . 0.0 106.495 176.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -113.64 -23.65 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.66 -178.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 26.5 p-90 -129.48 135.49 48.7 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.636 0.774 . . . . 0.0 109.19 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.656 HG11 ' HB1' ' A' ' 16' ' ' ALA . 33.4 t -136.03 166.34 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 175.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 65.1 p -123.55 161.67 24.48 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.946 0.898 . . . . 0.0 109.757 175.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -128.18 123.7 34.98 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 104.684 -2.339 . . . . 0.0 104.684 175.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -95.21 176.16 6.33 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 178.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -122.53 140.35 52.87 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -142.12 143.46 33.03 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.728 1.611 . . . . 0.0 107.219 178.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 36.62 -104.69 0.03 OUTLIER Glycine 0 CA--C 1.528 0.857 0 C-N-CA 126.281 1.896 . . . . 0.0 113.55 -177.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.7 p -125.08 33.53 5.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.629 1.572 . . . . 0.0 111.224 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.2 t -142.78 175.85 9.51 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 122.022 0.915 . . . . 0.0 111.812 176.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.5 mm -102.92 137.96 29.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 126.035 1.734 . . . . 0.0 106.432 177.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.13 165.28 33.4 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 123.78 0.832 . . . . 0.0 109.583 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.78 168.33 24.86 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 121.842 1.695 . . . . 0.0 111.607 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.24 -170.74 12.08 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 126.495 1.998 . . . . 0.0 109.472 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -61.33 161.8 8.65 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.105 1.362 . . . . 0.0 111.215 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -145.13 174.11 11.34 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.06 1.344 . . . . 0.0 111.336 -178.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.39 -175.92 42.35 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 124.074 0.845 . . . . 0.0 111.568 177.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.96 -26.61 6.82 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 125.941 1.696 . . . . 0.0 110.134 175.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -108.15 130.47 55.12 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -82.96 -10.3 58.86 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -174.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 42.1 tt0 -54.09 -39.34 66.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 120.746 1.612 . . . . 0.0 111.156 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -56.93 -38.6 73.11 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.929 1.292 . . . . 0.0 111.769 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -59.0 -37.62 77.3 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.743 1.217 . . . . 0.0 108.525 -177.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.8 mm -61.96 -49.76 82.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -175.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -66.72 -32.42 73.71 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.52 0.6 . . . . 0.0 111.817 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -60.83 -38.89 87.01 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-O 118.786 -0.626 . . . . 0.0 111.192 -176.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.3 m -57.75 118.68 5.54 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.049 0.94 . . . . 0.0 110.442 -176.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.505 ' OG1' HG22 ' A' ' 59' ' ' VAL . 2.5 p -83.92 -173.9 4.98 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 129.28 3.032 . . . . 0.0 111.943 -176.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 19.9 p-10 -78.34 -70.29 0.5 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.112 0.965 . . . . 0.0 111.553 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -106.24 -36.34 6.9 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.378 1.871 . . . . 0.0 113.807 -175.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.505 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -60.41 129.86 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -175.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.82 141.95 35.23 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.289 1.835 . . . . 0.0 106.19 -175.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 tp -142.5 169.36 17.71 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.56 1.144 . . . . 0.0 110.892 -174.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.662 ' CZ ' HG23 ' A' ' 97' ' ' THR . 11.3 m-85 -124.43 143.57 50.55 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -128.0 147.72 50.51 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 125.723 1.609 . . . . 0.0 110.331 176.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -121.31 124.06 43.67 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 104.394 -2.447 . . . . 0.0 104.394 177.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.5 t -136.8 143.6 34.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 O-C-N 123.358 0.411 . . . . 0.0 110.804 -175.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.3 119.04 25.23 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.315 1.446 . . . . 0.0 107.517 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -136.39 126.93 26.92 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.451 1.1 . . . . 0.0 109.048 -176.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.5 m -74.13 113.74 11.66 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 124.591 1.157 . . . . 0.0 110.169 -175.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 m -145.33 157.27 44.08 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 119.429 1.013 . . . . 0.0 111.025 176.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 89.7 125.59 2.83 Favored Glycine 0 C--N 1.333 0.403 0 C-N-CA 126.958 2.218 . . . . 0.0 110.341 176.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -83.56 122.8 29.05 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 126.596 1.958 . . . . 0.0 107.931 -175.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.62 172.36 13.71 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 125.778 1.631 . . . . 0.0 107.073 175.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -79.77 -6.9 58.18 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.04 0.536 . . . . 0.0 110.324 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.5 m -114.64 170.61 8.19 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 127.447 2.299 . . . . 0.0 110.442 -175.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -71.34 149.29 46.22 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 105.353 -2.092 . . . . 0.0 105.353 175.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -133.63 154.56 50.81 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 175.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.2 t -145.09 128.76 17.17 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -135.3 175.7 9.34 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -138.89 141.21 38.57 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.291 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -115.87 134.18 55.26 Favored 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 125.899 1.68 . . . . 0.0 107.438 -178.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -102.92 113.57 27.12 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 175.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mp -107.13 138.73 31.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 -175.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.3 m -121.32 123.47 42.24 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 104.766 -2.309 . . . . 0.0 104.766 -177.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 55.3 t-105 -93.02 123.35 36.21 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 176.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.575 HD11 HG21 ' A' ' 97' ' ' THR . 5.9 mm -145.45 85.46 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 -177.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.655 ' O ' HG12 ' A' ' 89' ' ' VAL . . . -56.25 153.91 16.64 Favored Glycine 0 CA--C 1.532 1.136 0 O-C-N 121.551 -0.718 . . . . 0.0 112.205 -175.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -61.57 -19.44 62.17 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.565 -1.55 . . . . 0.0 112.132 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -83.36 -13.59 54.65 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 121.103 -0.998 . . . . 0.0 111.715 -176.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.655 HG12 ' O ' ' A' ' 86' ' ' GLY . 12.7 p -72.64 131.93 34.12 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-N 120.001 1.273 . . . . 0.0 110.007 179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 37.8 t -60.14 149.46 32.66 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.95 0.9 . . . . 0.0 109.367 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -58.53 -26.5 59.75 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 175.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.2 tt -68.89 -51.11 43.59 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 119.201 1.5 . . . . 0.0 110.668 177.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 19.9 mp0 -60.99 -38.82 87.35 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.315 -0.866 . . . . 0.0 109.5 175.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -61.62 -32.5 72.64 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.753 0.821 . . . . 0.0 111.248 175.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.79 -23.87 67.38 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 117.744 -1.122 . . . . 0.0 112.394 177.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.46 -54.05 50.24 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.913 1.688 . . . . 0.0 107.885 175.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.662 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 58.6 m -51.99 -38.22 55.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.864 0.866 . . . . 0.0 108.892 175.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -57.89 -19.87 38.67 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.067 1.318 . . . . 0.0 115.413 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 10.8 m -119.15 -2.94 10.64 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.816 1.808 . . . . 0.0 111.283 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -103.03 -23.7 13.67 Favored 'General case' 0 CA--C 1.516 -0.334 0 O-C-N 121.107 -0.995 . . . . 0.0 112.897 -175.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -49.77 -39.23 37.26 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.495 1.498 . . . . 0.0 112.604 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.8 t -59.87 -30.48 69.02 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.368 0.531 . . . . 0.0 111.753 -179.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.4 mt -64.47 -63.36 1.15 Allowed 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 124.562 1.145 . . . . 0.0 109.014 -178.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.436 HG12 ' H ' ' A' ' 104' ' ' VAL 0.251 0.9 OUTLIER -59.29 -29.38 41.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-O 118.603 -0.713 . . . . 0.0 109.655 175.83 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -63.32 -47.25 83.01 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 120.104 1.32 . . . . 0.0 109.017 175.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -52.42 -30.67 30.56 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.103 1.361 . . . . 0.0 111.92 -178.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 91.9 t -84.02 -54.41 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 124.054 0.942 . . . . 0.0 109.682 176.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 47.6 t -86.32 26.12 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 127.39 2.276 . . . . 0.0 114.081 -175.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -53.1 -26.55 16.78 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 119.749 -1.844 . . . . 0.0 114.752 -175.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -91.4 83.52 5.45 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -145.65 175.4 10.4 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 126.135 1.774 . . . . 0.0 107.759 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -101.95 -66.21 0.94 Allowed 'General case' 0 C--O 1.234 0.275 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -175.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -144.35 172.52 12.82 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 125.043 1.337 . . . . 0.0 109.598 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -126.59 168.37 14.4 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.159 0.984 . . . . 0.0 110.647 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -148.44 157.59 43.57 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 105.302 -2.11 . . . . 0.0 105.302 -175.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.4 t -131.8 124.19 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -123.92 141.53 43.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -179.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.3 p -129.26 3.2 5.17 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.517 1.127 . . . . 0.0 113.726 -176.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -137.73 124.56 21.2 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.693 1.197 . . . . 0.0 108.363 -175.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -64.56 -25.02 67.8 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.842 0.857 . . . . 0.0 112.189 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 32.6 mtmt -74.24 -47.32 35.98 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 119.973 1.261 . . . . 0.0 108.438 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -59.84 -39.17 84.22 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.622 -0.704 . . . . 0.0 111.662 178.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -44.04 -23.19 0.08 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 130.768 3.627 . . . . 0.0 115.554 -175.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -46.42 135.79 7.94 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 126.095 1.758 . . . . 0.0 109.68 175.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -63.87 -14.06 50.21 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 121.569 -0.707 . . . . 0.0 112.653 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -57.8 -55.32 36.44 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 119.168 0.895 . . . . 0.0 110.446 -176.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.33 -26.68 60.3 Favored 'General case' 0 C--N 1.351 0.657 0 C-N-CA 115.488 -2.485 . . . . 0.0 109.383 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 69.4 mt -60.41 -46.02 95.81 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -56.79 -52.69 64.05 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.31 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 34.1 t -61.85 -41.81 98.27 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.737 0.698 . . . . 0.0 110.335 -177.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -62.95 -51.31 67.38 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 123.668 0.787 . . . . 0.0 109.749 177.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 98.0 mt -63.7 -31.5 72.69 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.289 -1.507 . . . . 0.0 111.628 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -47.98 75.66 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.515 1.526 . . . . 0.0 107.953 175.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 46.9 mttm -62.02 -41.59 98.25 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.821 0.848 . . . . 0.0 109.234 175.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.27 -25.42 66.86 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.818 1.647 . . . . 0.0 112.98 -176.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 24.09 -94.14 0.01 OUTLIER Glycine 0 C--N 1.343 0.967 0 C-N-CA 128.53 2.967 . . . . 0.0 112.753 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 98.94 175.04 31.99 Favored Glycine 0 CA--C 1.521 0.445 0 C-N-CA 125.682 1.611 . . . . 0.0 112.779 175.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -103.93 108.53 19.9 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.28 1.032 . . . . 0.0 110.017 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 -156.1 100.77 2.04 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.406 1.082 . . . . 0.0 108.127 175.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -92.44 85.57 5.39 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -133.44 113.45 12.53 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 131.484 3.914 . . . . 0.0 104.914 -176.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.04 136.65 13.29 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.802 2.041 . . . . 0.0 106.438 178.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -141.96 152.92 43.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.177 -2.157 . . . . 0.0 105.177 175.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 76.38 56.04 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 -175.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.256 1.441 0 C-N-CA 126.756 2.022 . . . . 0.0 106.356 176.923 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.659 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.0 mt -81.08 77.11 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 177.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -155.51 23.79 0.4 Allowed 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.614 -1.304 . . . . 0.0 110.619 -177.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.24 174.74 5.84 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.997 0.919 . . . . 0.0 111.402 -175.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -138.35 68.57 1.39 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 126.437 1.895 . . . . 0.0 107.349 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.591 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.5 m -135.81 168.89 18.46 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 175.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -133.86 -178.31 4.96 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.556 -1.34 . . . . 0.0 112.662 -178.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.24 151.37 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 124.498 1.119 . . . . 0.0 108.933 178.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -93.61 77.41 4.34 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 101.881 -3.377 . . . . 0.0 101.881 174.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.77 -24.45 65.77 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.966 -1.016 . . . . 0.0 112.85 -175.161 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -70.24 -56.48 6.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 119.641 1.11 . . . . 0.0 109.128 -175.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.52 86.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.56 0.344 . . . . 0.0 110.488 176.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 78.1 m -64.99 -36.09 83.28 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.727 -0.608 . . . . 0.0 111.501 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -61.24 -35.0 76.04 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 117.461 -1.257 . . . . 0.0 110.092 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.55 -53.21 59.35 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 120.248 1.385 . . . . 0.0 110.541 -178.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.553 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -64.63 -41.02 96.44 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.752 0.706 . . . . 0.0 111.261 178.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -56.79 -39.08 73.46 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.268 1.027 . . . . 0.0 110.057 177.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -66.67 -46.32 76.05 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 126.141 1.776 . . . . 0.0 110.785 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.5 mp -58.62 -52.76 64.3 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 118.784 0.72 . . . . 0.0 112.001 175.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.487 ' CG2' HG23 ' A' ' 30' ' ' VAL . 31.5 t -63.52 -36.51 76.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 118.777 0.717 . . . . 0.0 110.603 -179.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.4 ttm-85 -63.7 -37.52 87.66 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 118.817 -0.611 . . . . 0.0 110.308 175.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -75.44 141.09 43.23 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 124.28 1.032 . . . . 0.0 113.189 -175.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -86.33 -11.85 50.99 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 126.448 1.899 . . . . 0.0 112.87 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -88.14 -35.8 8.67 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.0 t -54.39 138.45 39.69 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.892 1.677 . . . . 0.0 108.74 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.6 -35.52 60.52 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 175.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.8 t -63.08 127.22 22.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 C-N-CA 125.971 1.709 . . . . 0.0 109.99 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.5 pp -114.96 -23.83 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 126.489 1.916 . . . . 0.0 111.874 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 42.6 p-90 -126.27 148.86 49.42 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 119.577 1.08 . . . . 0.0 109.015 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.553 HG21 ' HB1' ' A' ' 16' ' ' ALA . 6.4 t -140.02 161.35 26.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 127.356 2.262 . . . . 0.0 106.682 176.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 17.2 p -124.07 156.73 36.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -132.5 124.7 29.02 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -110.32 176.47 5.04 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 -176.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.434 ' CE2' ' CD1' ' A' ' 39' ' ' ILE . 36.0 m-85 -123.28 136.5 54.72 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -176.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -148.76 124.03 10.21 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 175.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 54.95 -128.59 43.83 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 p -86.73 9.78 17.84 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.8 t -143.56 171.77 13.71 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 120.228 1.376 . . . . 0.0 114.604 -175.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.434 ' CD1' ' CE2' ' A' ' 34' ' ' TYR . 51.0 mm -90.76 137.13 22.32 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 101.826 -3.398 . . . . 0.0 101.826 174.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.1 m -121.83 158.95 53.17 Favored Pre-proline 0 C--O 1.236 0.376 0 C-N-CA 123.521 0.728 . . . . 0.0 110.132 176.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.19 154.61 61.82 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 121.167 1.245 . . . . 0.0 110.139 175.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.83 -171.31 15.0 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 127.295 2.379 . . . . 0.0 109.213 175.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -64.67 167.51 7.22 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 122.186 -0.597 . . . . 0.0 110.407 175.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -149.69 162.14 40.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.998 1.319 . . . . 0.0 109.02 -177.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -177.36 177.37 48.3 Favored Glycine 0 CA--C 1.524 0.615 0 CA-C-N 117.999 0.363 . . . . 0.0 112.227 -176.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -106.94 -7.23 17.1 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.222 1.409 . . . . 0.0 113.726 -175.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.6 137.93 45.71 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.737 1.215 . . . . 0.0 108.913 -175.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -84.54 -10.84 57.06 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 -175.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -61.45 -42.85 99.4 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 119.85 -1.781 . . . . 0.0 111.894 -176.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 75.4 m80 -68.96 -22.71 64.1 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.016 0.825 . . . . 0.0 111.393 178.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -61.83 -31.43 71.67 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 120.658 -1.277 . . . . 0.0 111.75 177.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.449 ' HA ' HD12 ' A' ' 123' ' ' LEU . 6.4 mm -62.03 -34.42 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -82.9 -32.64 27.21 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 117.834 -1.079 . . . . 0.0 110.099 175.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -53.82 -42.86 68.87 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 120.007 1.276 . . . . 0.0 111.081 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 76.5 m -60.89 113.42 2.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.415 ' OG1' HG22 ' A' ' 59' ' ' VAL . 2.3 p -83.62 176.93 8.65 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.466 1.506 . . . . 0.0 110.915 -176.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -72.19 -58.24 3.58 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 117.813 2.523 . . . . 0.0 117.813 -175.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -106.2 -35.51 7.17 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 117.181 2.289 . . . . 0.0 117.181 -174.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.415 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.7 m -67.77 173.37 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 123.007 1.384 . . . . 0.0 112.213 -175.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.8 ptt-85 -111.35 135.97 51.14 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 175.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 54.2 tp -134.48 162.15 33.05 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -131.99 147.23 52.44 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -139.38 126.97 21.75 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.37 0.668 . . . . 0.0 110.665 -178.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.415 ' CD1' HG13 ' A' ' 108' ' ' VAL . 37.6 t80 -95.65 123.36 39.17 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 101.933 -3.358 . . . . 0.0 101.933 175.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.2 t -135.09 136.17 51.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -175.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 15.2 ttm-85 -75.71 130.49 38.77 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.86 1.664 . . . . 0.0 106.853 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -136.28 157.92 45.66 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.251 1.02 . . . . 0.0 109.407 -177.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.0 m -116.26 113.43 22.99 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 120.77 -1.206 . . . . 0.0 109.973 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 32.6 m -152.14 157.91 42.2 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.928 1.291 . . . . 0.0 108.403 175.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 96.34 161.93 32.79 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 125.738 1.637 . . . . 0.0 111.124 176.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.24 139.09 39.07 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 124.287 1.035 . . . . 0.0 108.717 -177.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.8 -173.8 4.32 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 129.527 3.131 . . . . 0.0 104.508 175.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 87.5 mtp -68.33 -4.34 14.13 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.592 -1.318 . . . . 0.0 110.083 175.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.7 m -136.44 168.07 20.15 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.403 2.681 . . . . 0.0 109.589 -175.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.5 mmtt -71.13 164.93 24.64 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 175.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.3 mtp180 -131.59 168.62 17.38 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 -177.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.8 t -145.4 132.93 20.82 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.162 -1.422 . . . . 0.0 107.162 175.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp -123.48 176.08 6.39 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.761 2.024 . . . . 0.0 107.49 -177.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -141.89 143.73 33.46 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 176.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -119.91 133.32 55.61 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 177.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -97.71 113.12 24.81 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 175.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.5 mp -99.38 144.0 12.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.4 m -125.32 123.6 39.77 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 104.737 -2.32 . . . . 0.0 104.737 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.1 t-105 -100.68 131.89 46.35 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 175.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.0 mt -136.27 108.92 8.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 175.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -48.97 134.65 22.33 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 175.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.81 -7.01 9.42 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.179 -1.189 . . . . 0.0 113.112 -175.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -83.65 -23.63 31.72 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 120.188 -1.57 . . . . 0.0 112.96 176.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 14.2 p -85.82 123.02 39.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 120.921 1.691 . . . . 0.0 110.974 -175.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 25.3 t -146.67 124.14 11.7 Favored 'General case' 0 N--CA 1.443 -0.82 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 175.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.72 -167.17 27.2 Favored Glycine 0 C--O 1.24 0.494 0 N-CA-C 107.562 -2.215 . . . . 0.0 107.562 -175.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.0 tt -53.68 -39.36 65.07 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 117.915 0.857 . . . . 0.0 109.899 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -57.03 -36.22 70.21 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.389 0.995 . . . . 0.0 111.248 -176.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.25 -49.58 27.0 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 175.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.18 -24.04 51.7 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.525 1.13 . . . . 0.0 112.844 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -50.24 -45.01 53.68 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 124.764 1.225 . . . . 0.0 109.384 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.4 m -55.09 -39.13 68.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 118.891 0.769 . . . . 0.0 110.886 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.05 -26.12 74.14 Favored Glycine 0 CA--C 1.526 0.737 0 CA-C-N 119.164 0.893 . . . . 0.0 112.717 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 99.7 m -94.48 -17.92 21.97 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.995 1.718 . . . . 0.0 111.223 177.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -104.25 -23.56 13.22 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 126.201 1.8 . . . . 0.0 115.178 -174.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -52.46 -27.86 17.85 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 120.817 1.644 . . . . 0.0 113.902 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.7 t -62.64 -43.78 97.94 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.827 1.194 . . . . 0.0 109.404 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.591 HD11 ' HB ' ' A' ' 6' ' ' THR . 18.7 mt -55.2 -65.3 0.61 Allowed 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 125.774 1.63 . . . . 0.0 110.758 -175.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.406 HG12 ' H ' ' A' ' 104' ' ' VAL 0.288 0.8 OUTLIER -58.88 -28.67 38.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.564 176.196 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.8 tttm -69.24 -35.37 76.07 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 121.017 1.735 . . . . 0.0 110.312 175.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -57.71 -28.91 64.27 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 120.327 1.421 . . . . 0.0 110.366 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 89.3 t -79.97 -64.44 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 175.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.415 HG13 ' CD1' ' A' ' 64' ' ' PHE . 86.8 t -67.06 25.35 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 130.069 3.348 . . . . 0.0 114.431 -175.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -55.35 -26.6 41.92 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 118.884 -2.385 . . . . 0.0 115.217 -175.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -92.65 83.71 4.92 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 175.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -147.03 166.14 27.74 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.119 0.485 . . . . 0.0 109.702 175.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -92.72 -66.49 0.92 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.922 1.289 . . . . 0.0 110.04 -175.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -145.97 176.31 9.79 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 127.903 2.481 . . . . 0.0 109.592 175.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -117.14 167.48 11.15 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.693 1.197 . . . . 0.0 110.789 177.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -146.51 148.68 32.46 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -175.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 48.2 t -126.95 127.06 69.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 175.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mp -129.44 142.56 43.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 N-CA-C 106.348 -1.723 . . . . 0.0 106.348 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 p -130.08 -0.75 4.66 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 176.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.422 ' OD1' ' HE3' ' A' ' 121' ' ' LYS . 31.4 t0 -118.78 124.14 46.53 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.227 0.921 . . . . 0.0 109.267 176.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -65.63 -24.33 67.02 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.802 0.841 . . . . 0.0 111.189 -176.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.422 ' HE3' ' OD1' ' A' ' 119' ' ' ASP . 24.2 mtmt -76.45 -32.5 58.45 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.087 1.355 . . . . 0.0 110.017 175.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.61 -35.17 45.99 Favored 'General case' 0 C--O 1.215 -0.742 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.449 HD12 ' HA ' ' A' ' 52' ' ' ILE . 3.0 tm? -44.5 -23.14 0.1 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 131.173 3.789 . . . . 0.0 114.993 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -45.64 140.35 3.41 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.616 1.966 . . . . 0.0 110.374 175.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -64.76 -14.65 59.7 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.384 -0.823 . . . . 0.0 111.981 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -54.13 -52.41 61.16 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 118.228 -0.892 . . . . 0.0 112.793 -175.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -85.72 -26.23 26.0 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 117.034 -1.866 . . . . 0.0 109.0 -176.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 47.0 mt -58.64 -48.11 86.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -54.71 -54.54 40.47 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.513 -0.756 . . . . 0.0 110.467 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 29.8 t -60.67 -39.3 87.89 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.124 0.874 . . . . 0.0 110.299 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -68.96 -45.04 71.7 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.703 -0.623 . . . . 0.0 110.752 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.4 -33.56 76.16 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.319 1.048 . . . . 0.0 111.18 176.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -66.33 -51.51 56.54 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.444 1.498 . . . . 0.0 108.164 175.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -56.08 -45.07 79.48 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.237 0.926 . . . . 0.0 109.05 175.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.01 -2.84 8.41 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.876 1.27 . . . . 0.0 114.156 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -76.26 55.5 3.21 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.215 1.388 . . . . 0.0 111.759 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -100.81 66.96 0.5 Allowed Glycine 0 CA--C 1.519 0.33 0 N-CA-C 109.915 -1.274 . . . . 0.0 109.915 178.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -144.86 113.36 6.65 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.451 1.1 . . . . 0.0 108.571 176.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -70.7 149.15 47.26 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -140.91 102.05 4.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 175.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -149.0 149.36 31.02 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 175.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.02 136.3 13.03 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 127.403 2.281 . . . . 0.0 106.665 176.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -148.5 139.6 23.18 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 175.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 4.1 m 57.65 54.05 6.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -175.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.4 mp0 . . . . . 0 C--O 1.254 1.327 0 C-N-CA 129.563 3.145 . . . . 0.0 111.865 -175.395 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.648 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 4.8 mp -139.58 124.47 20.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 N-CA-C 105.873 -1.899 . . . . 0.0 105.873 -173.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -143.84 83.8 1.76 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-N 118.843 0.747 . . . . 0.0 109.006 176.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.21 163.92 30.5 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 175.491 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.72 78.18 8.48 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 175.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.606 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.5 m -68.04 162.66 24.07 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 175.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -132.33 -179.35 5.38 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 120.964 -1.085 . . . . 0.0 109.282 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.47 HG22 ' HB3' ' A' ' 103' ' ' LEU . 0.2 OUTLIER -139.82 150.53 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 124.795 1.238 . . . . 0.0 109.063 178.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -96.74 79.92 3.01 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 102.012 -3.329 . . . . 0.0 102.012 174.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -65.95 -24.24 66.77 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 117.819 -1.086 . . . . 0.0 112.953 -175.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -66.41 -56.11 12.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 176.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.83 -45.15 87.37 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 122.065 -0.397 . . . . 0.0 111.303 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.654 ' HB3' HG11 ' A' ' 107' ' ' VAL . 17.6 m -60.6 -40.37 91.55 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 118.484 -0.77 . . . . 0.0 111.224 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -62.21 -32.87 73.58 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.586 178.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.33 9.07 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 120.242 1.383 . . . . 0.0 110.014 176.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.452 ' HB1' HG11 ' A' ' 30' ' ' VAL . . . -54.45 -48.36 71.81 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.823 -0.548 . . . . 0.0 111.828 178.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -52.86 -48.59 66.96 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 124.004 0.922 . . . . 0.0 110.436 175.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.69 -43.83 98.1 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 117.1 -1.429 . . . . 0.0 110.677 -178.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.6 mp -58.01 -60.53 3.58 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 119.483 1.038 . . . . 0.0 109.534 175.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.467 ' CG2' HG23 ' A' ' 30' ' ' VAL . 43.9 t -59.74 -31.64 47.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 O-C-N 121.846 -0.534 . . . . 0.0 111.407 -176.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -73.33 -26.7 61.15 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.437 -0.79 . . . . 0.0 111.296 176.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -80.15 123.73 28.16 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.22 0.918 . . . . 0.0 110.025 -176.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.28 -23.0 67.15 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 123.66 0.784 . . . . 0.0 110.367 175.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.13 -3.87 88.67 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.075 1.798 . . . . 0.0 114.303 177.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.3 t -85.77 130.64 34.5 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.766 1.783 . . . . 0.0 109.608 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.6 -35.98 75.79 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 175.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 t -63.17 131.04 28.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 175.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.1 pp -114.39 -23.6 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 126.034 1.733 . . . . 0.0 110.503 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.472 ' HB2' HG22 ' A' ' 65' ' ' VAL . 37.5 p-90 -131.09 141.77 50.2 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.296 1.039 . . . . 0.0 111.092 178.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.467 HG23 ' CG2' ' A' ' 20' ' ' VAL . 61.2 t -137.1 147.22 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 175.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.468 HG22 ' HB2' ' A' ' 63' ' ' ALA . 40.3 p -103.8 162.43 13.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.082 0.468 . . . . 0.0 109.83 178.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -134.32 141.82 47.05 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.768 1.627 . . . . 0.0 107.132 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -124.82 176.82 6.36 Favored 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 125.356 1.463 . . . . 0.0 107.569 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -113.9 145.05 42.04 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.456 0.646 . . . . 0.0 110.312 176.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -129.92 123.46 30.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 103.408 -2.812 . . . . 0.0 103.408 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 38.05 -94.28 0.01 OUTLIER Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.26 1.41 . . . . 0.0 113.883 -176.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.4 p -124.71 34.51 4.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.142 1.777 . . . . 0.0 112.994 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.8 t -144.71 172.86 12.41 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.321 1.048 . . . . 0.0 112.194 175.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.4 mm -98.4 132.35 43.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 C-N-CA 125.455 1.502 . . . . 0.0 107.028 176.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.5 m -120.65 160.52 43.94 Favored Pre-proline 0 C--O 1.235 0.327 0 C-N-CA 124.879 1.272 . . . . 0.0 110.251 175.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.02 160.88 44.85 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 120.971 1.114 . . . . 0.0 110.84 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -128.87 -173.11 13.33 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 106.837 -2.505 . . . . 0.0 106.837 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -69.8 171.59 8.98 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.822 -0.811 . . . . 0.0 111.212 177.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.7 pm0 -142.11 171.63 13.8 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.085 1.354 . . . . 0.0 111.749 -175.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.99 167.7 39.91 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-O 122.085 0.825 . . . . 0.0 112.695 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -112.93 -9.05 13.66 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 127.529 2.332 . . . . 0.0 112.474 -175.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.23 144.9 45.1 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 104.964 -2.235 . . . . 0.0 104.964 -177.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -84.06 -15.85 45.99 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -175.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -58.19 -37.22 74.35 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 120.916 1.689 . . . . 0.0 110.138 -178.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -73.38 -21.8 60.42 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.328 -0.857 . . . . 0.0 112.189 176.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -62.1 -46.47 88.91 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 120.423 1.465 . . . . 0.0 109.535 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.4 mp -61.39 -37.69 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -65.59 -39.04 91.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 122.668 0.387 . . . . 0.0 111.368 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -73.13 -24.02 60.55 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 126.543 1.937 . . . . 0.0 114.729 -175.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 85.1 m -63.67 118.12 7.8 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.289 2.3 p -82.72 163.2 21.47 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 122.662 1.22 . . . . 0.0 111.458 -175.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -46.6 -75.48 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 130.655 3.582 . . . . 0.0 115.949 -175.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -102.04 -36.63 8.51 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 -175.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 18.5 m -62.12 166.98 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 -175.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -107.42 135.17 49.35 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 175.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.4 tp -132.29 170.82 14.51 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.179 1.792 . . . . 0.0 108.585 -175.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -136.33 157.03 47.77 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 124.537 1.135 . . . . 0.0 108.354 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.468 ' HB2' HG22 ' A' ' 31' ' ' THR . . . -152.67 129.71 11.09 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 119.17 0.895 . . . . 0.0 112.875 175.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -89.78 123.52 33.84 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 105.154 -2.165 . . . . 0.0 105.154 175.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.472 HG22 ' HB2' ' A' ' 29' ' ' TRP . 41.5 t -138.93 149.93 23.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 122.865 0.466 . . . . 0.0 110.61 -175.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -103.28 145.5 29.86 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.108 0.963 . . . . 0.0 110.325 175.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -136.5 149.9 48.4 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.131 1.373 . . . . 0.0 110.728 -176.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.7 m -96.06 122.95 39.44 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 87.2 m -90.17 171.59 9.4 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.442 -0.786 . . . . 0.0 109.317 -176.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.62 114.57 6.4 Favored Glycine 0 C--N 1.339 0.705 0 N-CA-C 109.036 -1.626 . . . . 0.0 109.036 175.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -70.1 169.9 12.57 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 127.31 2.244 . . . . 0.0 111.767 -175.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.57 -172.76 4.04 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 131.172 3.789 . . . . 0.0 105.597 175.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 87.0 mtp -49.42 -2.87 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 126.968 2.107 . . . . 0.0 113.895 175.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.9 m -145.77 128.25 16.0 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.45 3.5 . . . . 0.0 103.06 175.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -64.4 162.76 14.45 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -175.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 67.3 mtt180 -136.16 154.2 51.04 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 122.773 1.273 . . . . 0.0 110.732 -176.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 47.8 t -145.75 160.0 42.37 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 177.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -144.27 168.11 20.85 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 104.824 -2.287 . . . . 0.0 104.824 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -121.55 139.77 53.08 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 105.744 -1.947 . . . . 0.0 105.744 176.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -123.94 114.03 19.26 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 104.817 -2.29 . . . . 0.0 104.817 -176.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -89.09 113.29 24.42 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 102.892 -3.003 . . . . 0.0 102.892 175.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 mp -88.59 140.35 15.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.5 m -125.96 123.18 37.95 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 102.232 -3.247 . . . . 0.0 102.232 175.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 48.2 t-105 -101.6 123.85 46.28 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 25.4 mt -142.2 78.39 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.09 149.96 11.0 Favored Glycine 0 CA--C 1.53 1.017 0 N-CA-C 108.792 -1.723 . . . . 0.0 108.792 175.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -68.19 -10.72 56.46 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.43 2.115 . . . . 0.0 113.001 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -83.6 -36.32 24.01 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 117.256 -1.354 . . . . 0.0 113.191 -175.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -53.21 133.92 15.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 CA-C-N 120.354 1.434 . . . . 0.0 110.049 175.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 31.4 t -58.72 156.48 10.96 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 123.209 1.481 . . . . 0.0 113.032 -175.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -57.64 -13.8 13.07 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 113.175 -1.83 . . . . 0.0 111.617 175.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.7 tp -72.01 -61.28 1.85 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 126.098 1.759 . . . . 0.0 110.621 175.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 16.1 mp0 -68.55 -34.25 75.52 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.8 ttm180 -60.37 -42.66 96.27 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 175.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.27 -36.34 83.8 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-O 118.107 -0.949 . . . . 0.0 111.617 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -55.84 -38.38 69.99 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.945 1.248 . . . . 0.0 110.602 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 74.2 m -54.31 -34.52 61.16 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 119.739 1.154 . . . . 0.0 110.467 178.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.75 -25.73 70.65 Favored Glycine 0 CA--C 1.527 0.806 0 O-C-N 121.009 -1.057 . . . . 0.0 113.761 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.7 m -99.12 -13.41 19.81 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.589 1.956 . . . . 0.0 110.88 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -103.41 -24.11 13.5 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -174.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 43.5 mtmt -59.73 -39.96 86.44 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 120.986 1.721 . . . . 0.0 111.149 -178.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.9 t -62.56 -31.22 71.98 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 118.611 -0.709 . . . . 0.0 110.732 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.606 HD11 ' HB ' ' A' ' 6' ' ' THR . 15.4 mt -62.81 -63.2 1.28 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 119.416 1.007 . . . . 0.0 109.573 -176.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -61.07 -30.36 47.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 117.188 -1.387 . . . . 0.0 109.455 175.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -61.91 -37.27 84.0 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 121.288 1.858 . . . . 0.0 110.288 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -60.79 -24.64 65.96 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 120.201 1.364 . . . . 0.0 111.117 179.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.654 HG11 ' HB3' ' A' ' 13' ' ' CYS . 43.7 t -86.82 -53.03 11.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 79.2 t -74.95 26.11 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 130.393 3.477 . . . . 0.0 111.427 -177.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -55.32 -26.13 38.74 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 119.618 -1.926 . . . . 0.0 112.492 -176.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -95.55 90.55 5.78 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 175.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -157.96 176.74 12.15 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.948 1.299 . . . . 0.0 108.041 179.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -106.31 -66.5 1.0 Allowed 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.829 -0.544 . . . . 0.0 112.013 177.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 14.0 mtpt -146.06 168.9 19.81 Favored 'General case' 0 CA--C 1.504 -0.826 0 C-N-CA 126.812 2.045 . . . . 0.0 110.017 176.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.33 179.72 4.19 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.82 -1.082 . . . . 0.0 109.553 175.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.25 140.63 23.25 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 104.256 -2.498 . . . . 0.0 104.256 -176.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.8 t -114.27 123.72 70.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -125.99 138.39 54.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 106.131 -1.803 . . . . 0.0 106.131 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.0 p -131.51 1.79 4.11 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -175.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -137.12 134.2 36.14 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.816 0.734 . . . . 0.0 109.455 177.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 17.3 ttp-105 -69.15 -28.83 66.78 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 118.195 -0.907 . . . . 0.0 112.723 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -70.42 -45.38 66.01 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 120.853 1.661 . . . . 0.0 106.623 175.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -58.37 -43.84 88.59 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 117.907 -1.044 . . . . 0.0 109.351 -176.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -44.04 -23.74 0.11 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 129.568 3.147 . . . . 0.0 115.081 -177.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -50.44 154.91 1.16 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 122.502 1.144 . . . . 0.0 114.064 175.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -61.08 -15.66 35.17 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 115.119 -0.946 . . . . 0.0 113.18 175.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -51.43 -64.95 0.65 Allowed 'General case' 0 C--O 1.242 0.689 0 CA-C-N 119.11 0.868 . . . . 0.0 111.022 176.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.92 -26.59 54.26 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 114.984 -2.686 . . . . 0.0 109.389 -175.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.7 -41.23 91.9 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 C-N-CA 123.7 0.8 . . . . 0.0 108.885 -176.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -62.1 -53.0 61.64 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 120.028 1.285 . . . . 0.0 109.929 179.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 44.0 t -65.08 -34.67 78.96 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 119.222 -0.418 . . . . 0.0 110.538 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -72.56 -44.38 62.16 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 123.902 0.881 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 65.0 mt -61.79 -31.05 71.23 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 118.342 -0.837 . . . . 0.0 108.853 175.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -69.43 -52.76 23.76 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.368 1.067 . . . . 0.0 109.298 174.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -51.34 -56.85 10.88 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.328 1.051 . . . . 0.0 109.531 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -76.15 8.14 3.55 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.528 1.931 . . . . 0.0 113.794 177.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -113.87 -48.84 0.56 Allowed Glycine 0 C--N 1.335 0.496 0 CA-C-O 118.592 -1.116 . . . . 0.0 112.741 -175.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 138.79 175.08 13.76 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.45 -1.06 . . . . 0.0 110.45 -176.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.25 153.86 42.68 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.294 0.568 . . . . 0.0 109.841 176.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -151.1 81.22 1.32 Allowed 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 104.543 -2.391 . . . . 0.0 104.543 175.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -148.02 116.46 6.6 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 130.536 3.534 . . . . 0.0 101.566 -176.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -128.99 154.96 46.1 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 105.391 -2.078 . . . . 0.0 105.391 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.1 102.56 2.96 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 125.371 1.469 . . . . 0.0 107.743 -175.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -147.97 149.22 31.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 125.777 1.631 . . . . 0.0 106.681 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 86.02 35.91 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 127.959 2.504 . . . . 0.0 108.452 -175.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 . . . . . 0 C--O 1.248 1.008 0 C-N-CA 129.569 3.148 . . . . 0.0 103.547 175.877 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.907 0 N-CA-C 110.087 -1.205 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.499 HG23 ' H ' ' A' ' 3' ' ' ARG . 6.0 tp -146.89 -78.99 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.074 0.937 . . . . 0.0 110.857 173.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.499 ' H ' HG23 ' A' ' 2' ' ' ILE . 16.7 ttt180 -74.74 97.02 3.15 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 124.178 0.991 . . . . 0.0 109.882 -175.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -147.26 171.32 15.59 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 175.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -120.15 92.84 3.87 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 127.747 2.419 . . . . 0.0 107.074 176.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.4 ' HB ' HD11 ' A' ' 103' ' ' LEU . 2.4 m -119.05 170.89 8.66 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.63 1.972 . . . . 0.0 105.754 -177.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.0 tttt -139.04 176.28 8.83 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.612 -1.305 . . . . 0.0 111.247 -176.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.82 152.21 24.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 124.115 0.966 . . . . 0.0 108.961 175.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -100.34 78.6 2.05 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 104.678 -2.341 . . . . 0.0 104.678 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -61.89 -27.78 69.04 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.098 -0.953 . . . . 0.0 112.506 -175.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.22 -48.36 70.85 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 119.822 1.192 . . . . 0.0 110.255 177.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.16 -52.87 20.12 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.729 0.412 . . . . 0.0 110.121 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 73.9 m -62.31 -30.56 71.24 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.102 -0.951 . . . . 0.0 111.379 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.2 ttt180 -62.18 -35.19 78.1 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 115.946 -1.978 . . . . 0.0 109.112 175.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.87 -59.78 4.19 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 121.033 1.742 . . . . 0.0 109.906 -177.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.32 95.35 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.968 -0.458 . . . . 0.0 111.919 -178.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -54.76 -46.31 74.34 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 175.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -58.07 -47.75 82.23 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.213 1.405 . . . . 0.0 110.102 -175.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -57.19 -62.92 1.42 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.014 0.926 . . . . 0.0 109.855 175.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.1 t -60.2 -24.95 32.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 O-C-N 121.559 -0.713 . . . . 0.0 112.244 -176.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -75.73 -31.33 59.57 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.45 1.1 . . . . 0.0 111.725 175.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -86.24 125.29 33.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 127.687 2.395 . . . . 0.0 112.665 -175.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.66 -19.47 58.4 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.232 1.013 . . . . 0.0 112.843 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.99 -10.09 86.42 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.015 1.293 . . . . 0.0 113.464 176.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.6 t -79.61 127.52 32.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 119.326 1.563 . . . . 0.0 109.053 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.36 -35.73 73.73 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 175.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.6 t -64.38 133.2 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 127.633 2.373 . . . . 0.0 108.571 175.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 pp -115.94 -23.66 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 C-N-CA 126.109 1.763 . . . . 0.0 111.46 179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 51.0 p-90 -123.57 147.87 46.88 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.838 0.855 . . . . 0.0 109.74 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.9 t -137.07 162.92 33.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 129.513 3.125 . . . . 0.0 107.835 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.444 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 41.3 p -125.18 159.15 32.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.61 1.164 . . . . 0.0 109.075 175.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -132.44 123.8 27.36 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -102.86 176.23 5.22 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 175.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.419 ' CE2' HD12 ' A' ' 39' ' ' ILE . 27.1 m-85 -128.53 129.41 45.98 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 -175.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -129.08 131.02 47.23 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.919 1.688 . . . . 0.0 106.487 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 45.53 -114.53 1.28 Allowed Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.114 -1.195 . . . . 0.0 110.114 -176.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.5 p -120.74 45.61 2.2 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.968 1.307 . . . . 0.0 111.208 176.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.5 t -142.93 169.42 17.6 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.419 HD12 ' CE2' ' A' ' 34' ' ' TYR . 7.7 mm -98.61 139.4 20.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 175.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.3 m -128.53 146.18 58.94 Favored Pre-proline 0 N--CA 1.469 0.491 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.289 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.14 150.22 59.44 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 121.988 1.792 . . . . 0.0 109.288 175.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -124.3 -157.57 9.8 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 125.784 1.659 . . . . 0.0 110.629 177.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -51.56 161.5 0.49 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 125.906 1.682 . . . . 0.0 112.277 176.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.4 164.95 33.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.57 1.148 . . . . 0.0 109.124 176.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.73 176.96 44.05 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 123.578 0.609 . . . . 0.0 111.751 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -107.79 -15.61 14.52 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.355 1.462 . . . . 0.0 113.533 -176.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -123.63 142.63 50.86 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 -176.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -83.36 -8.91 59.33 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.799 1.036 . . . . 0.0 113.799 -174.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -54.1 -36.85 63.64 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 119.846 1.203 . . . . 0.0 110.137 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -62.68 -28.81 70.19 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.044 1.337 . . . . 0.0 112.158 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.424 ' CD1' HD11 ' A' ' 123' ' ' LEU . 0.7 OUTLIER -63.52 -52.45 61.16 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -178.966 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.52 -36.78 76.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -176.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -60.83 -31.88 71.29 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.67 0.788 . . . . 0.0 112.102 175.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -85.67 -24.04 27.19 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.008 0.923 . . . . 0.0 113.455 -175.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 96.6 m -59.85 120.75 10.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.602 1.092 . . . . 0.0 112.539 -175.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . 0.253 2.4 p -104.92 -173.53 2.32 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 127.181 2.192 . . . . 0.0 113.898 -178.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -73.67 -75.93 0.14 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 129.619 3.168 . . . . 0.0 117.964 -175.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -102.35 -24.76 13.83 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.051 1.74 . . . . 0.0 115.353 -174.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.7 m -63.94 158.78 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 CA-C-O 122.816 1.293 . . . . 0.0 112.37 -175.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.3 ptt-85 -108.41 130.65 55.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 102.894 -3.002 . . . . 0.0 102.894 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 31.8 tp -140.7 156.09 46.3 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -175.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -131.38 148.72 52.69 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.444 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.94 129.16 16.69 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.344 0.658 . . . . 0.0 111.629 -179.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.424 ' CE1' HG13 ' A' ' 108' ' ' VAL . 33.0 t80 -96.44 123.64 40.16 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 175.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 42.3 t -134.39 141.4 43.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 123.426 0.69 . . . . 0.0 109.304 -175.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -85.06 137.84 32.8 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 175.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -131.49 168.22 18.01 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 127.648 2.379 . . . . 0.0 106.622 -176.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 24.3 m -130.48 143.81 51.0 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 121.069 -1.02 . . . . 0.0 108.739 -177.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 3.6 m -83.48 160.76 21.45 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 120.839 -1.163 . . . . 0.0 108.018 175.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -54.08 135.18 43.93 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 108.691 -1.764 . . . . 0.0 108.691 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -46.49 136.64 7.32 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 128.269 2.628 . . . . 0.0 112.491 -175.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -138.98 179.75 6.31 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.135 1.774 . . . . 0.0 109.096 176.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 23.9 mmt -61.78 -5.71 2.18 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.832 1.253 . . . . 0.0 113.532 179.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.4 m -146.09 136.59 24.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.059 1.743 . . . . 0.0 106.547 175.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -46.16 152.84 0.37 Allowed 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.35 1.86 . . . . 0.0 113.254 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.3 mmt180 -121.21 148.32 44.42 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 123.638 0.775 . . . . 0.0 109.881 -176.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.6 t -146.89 137.82 23.92 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.658 1.583 . . . . 0.0 109.168 175.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.442 ' HA ' ' HE2' ' A' ' 78' ' ' LYS . 4.4 mmpt? -145.99 176.04 10.0 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 127.998 2.519 . . . . 0.0 108.115 175.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -141.56 146.36 36.23 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 176.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -125.47 122.44 36.65 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 176.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -97.65 113.33 25.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 100.421 -3.918 . . . . 0.0 100.421 174.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.9 mp -97.36 144.71 10.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -123.62 123.36 40.4 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 103.258 -2.867 . . . . 0.0 103.258 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -96.04 123.48 39.66 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 103.716 -2.698 . . . . 0.0 103.716 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.652 HD11 HG21 ' A' ' 97' ' ' THR . 12.3 mt -144.91 97.77 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 104.134 -2.543 . . . . 0.0 104.134 178.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.62 166.02 4.75 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-O 121.717 0.621 . . . . 0.0 113.07 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -75.78 -19.23 59.15 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.213 -1.757 . . . . 0.0 110.009 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -82.72 -20.71 35.49 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 120.812 -1.18 . . . . 0.0 113.486 -175.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . 0.257 0.8 OUTLIER -66.33 140.16 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 119.852 1.205 . . . . 0.0 113.373 -177.777 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 47.7 t -70.88 144.59 50.62 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 126.136 1.774 . . . . 0.0 109.89 179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -60.51 -21.16 57.11 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-O 119.179 -0.79 . . . . 0.0 113.205 179.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 tt -65.06 -32.58 74.36 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.872 1.336 . . . . 0.0 110.062 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -80.09 -44.07 20.66 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 175.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.8 ttp85 -58.62 -25.03 62.24 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.514 1.052 . . . . 0.0 111.298 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.34 70.57 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 120.849 -1.157 . . . . 0.0 111.861 175.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -64.99 -39.12 92.99 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-O 118.032 -0.985 . . . . 0.0 108.764 175.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.652 HG21 HD11 ' A' ' 85' ' ' ILE . 2.5 m -54.26 -34.81 61.64 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.383 0.673 . . . . 0.0 110.137 179.132 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.67 -12.37 56.37 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 125.135 1.35 . . . . 0.0 114.805 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.6 m -125.45 2.7 7.68 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.784 2.034 . . . . 0.0 110.603 175.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -103.62 -42.93 5.51 Favored 'General case' 0 C--O 1.226 -0.157 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -177.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.564 ' HE2' ' HG3' ' A' ' 114' ' ' GLU . 9.3 mtpm? -59.59 -28.81 67.49 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.52 -1.363 . . . . 0.0 112.44 -176.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.5 t -68.14 -47.01 69.23 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.458 1.503 . . . . 0.0 108.855 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.4 HD11 ' HB ' ' A' ' 6' ' ' THR . 14.5 mt -59.44 -58.04 10.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.855 1.662 . . . . 0.0 109.987 -176.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 1.4 p -62.21 -30.93 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-O 117.27 -1.347 . . . . 0.0 109.667 176.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.82 -31.16 72.24 Favored 'General case' 0 C--N 1.347 0.492 0 CA-C-N 121.178 1.808 . . . . 0.0 110.893 176.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -63.57 -25.73 68.37 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 120.154 1.343 . . . . 0.0 111.099 176.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 57.5 t -86.19 -56.97 4.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 175.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.424 HG13 ' CE1' ' A' ' 64' ' ' PHE . 86.3 t -73.01 26.65 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 131.106 3.762 . . . . 0.0 112.127 -175.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -52.76 -21.63 4.34 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 119.679 -1.888 . . . . 0.0 113.717 -176.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -99.02 84.39 3.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 174.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -147.42 170.11 18.07 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 175.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -96.29 -66.32 0.91 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -176.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -152.85 169.26 23.25 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 127.12 2.168 . . . . 0.0 108.159 175.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.564 ' HG3' ' HE2' ' A' ' 101' ' ' LYS . 0.7 OUTLIER -107.19 167.77 9.68 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 175.193 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -137.6 152.17 49.11 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 -175.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 33.8 t -121.24 124.87 72.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 175.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.9 mp -124.94 141.47 44.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 176.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.2 p -130.89 6.46 4.65 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.304 1.442 . . . . 0.0 112.827 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -139.81 128.87 23.65 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.573 0.624 . . . . 0.0 111.305 175.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 -64.99 -32.87 74.8 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 124.778 1.231 . . . . 0.0 113.966 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.696 ' H ' ' HE3' ' A' ' 121' ' ' LYS . 0.3 OUTLIER -76.21 -41.04 50.69 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 120.98 1.718 . . . . 0.0 109.667 176.622 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.9 -37.42 86.88 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.022 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.424 HD11 ' CD1' ' A' ' 51' ' ' PHE . 2.4 tm? -45.0 -23.65 0.16 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 129.382 3.073 . . . . 0.0 115.076 -176.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -44.41 140.19 2.4 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.74 1.216 . . . . 0.0 110.856 175.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -56.29 -14.56 2.94 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -54.01 -55.6 25.78 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 124.345 1.058 . . . . 0.0 111.97 177.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.42 -25.7 35.96 Favored 'General case' 0 C--N 1.352 0.682 0 C-N-CA 116.614 -2.035 . . . . 0.0 108.713 -177.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 64.8 mt -60.74 -49.04 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -55.61 -51.33 67.52 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.266 0.626 . . . . 0.0 109.878 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.0 t -63.88 -38.55 91.5 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.454 0.702 . . . . 0.0 111.007 -176.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -67.91 -40.29 83.46 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 124.838 1.255 . . . . 0.0 109.688 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 96.7 mt -72.82 -24.69 60.94 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.07 -1.018 . . . . 0.0 110.339 175.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 2.6 mtpt -73.78 -47.29 39.97 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 125.185 1.394 . . . . 0.0 108.403 175.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -54.01 -65.41 0.57 Allowed 'General case' 0 C--O 1.234 0.251 0 C-N-CA 126.247 1.819 . . . . 0.0 108.508 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.61 -13.34 41.22 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 176.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -65.03 -18.7 64.99 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 125.267 1.413 . . . . 0.0 111.847 176.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -76.16 97.49 1.16 Allowed Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 104.047 -3.621 . . . . 0.0 104.047 175.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.28 99.91 0.15 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.596 0.758 . . . . 0.0 110.064 -176.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -128.69 79.95 1.94 Allowed 'General case' 0 C--O 1.235 0.322 0 N-CA-C 103.709 -2.7 . . . . 0.0 103.709 175.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -139.47 90.74 2.43 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.93 150.04 45.91 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 125.418 1.487 . . . . 0.0 109.392 175.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -156.22 123.25 5.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 126.36 1.864 . . . . 0.0 106.559 175.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 96.6 mm-40 -115.45 168.4 10.02 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 175.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.7 m 54.69 43.06 30.73 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 122.005 0.907 . . . . 0.0 108.852 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 . . . . . 0 C--O 1.249 1.036 0 O-C-N 120.942 -1.099 . . . . 0.0 110.024 176.945 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.773 0 N-CA-C 109.901 -1.28 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 42.2 mm -54.07 123.2 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 C-N-CA 124.264 1.026 . . . . 0.0 110.397 -171.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 76.7 mtt85 -95.54 123.29 39.02 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 10.5 tpt -155.6 171.97 19.06 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -176.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -81.69 63.27 5.89 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 m -71.01 149.29 46.77 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.163 2.185 . . . . 0.0 106.283 175.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.6 mtmt -132.02 179.97 5.77 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.091 0.956 . . . . 0.0 109.413 -176.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.581 HG22 HG12 ' A' ' 39' ' ' ILE . 0.2 OUTLIER -121.25 153.67 24.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 C-N-CA 124.129 0.971 . . . . 0.0 110.189 176.188 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -91.57 80.57 5.39 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 103.682 -2.71 . . . . 0.0 103.682 175.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -62.88 -27.4 69.33 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 117.383 -1.294 . . . . 0.0 111.94 -175.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -72.33 -53.9 11.05 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 119.64 1.109 . . . . 0.0 109.236 178.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.39 -43.82 96.47 Favored 'General case' 0 CA--C 1.527 0.069 0 CA-C-N 118.342 0.519 . . . . 0.0 111.064 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 81.2 m -70.27 -30.6 67.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.373 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -61.15 -34.54 75.18 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-O 116.834 -1.555 . . . . 0.0 109.853 176.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.28 -57.73 10.08 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 119.753 1.161 . . . . 0.0 110.157 -177.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.49 ' HB1' HG21 ' A' ' 30' ' ' VAL . . . -66.86 -41.94 86.5 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.208 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -52.7 -40.13 62.67 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 123.312 0.645 . . . . 0.0 111.104 175.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -63.21 -45.06 93.46 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.81 0.844 . . . . 0.0 110.574 -176.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.53 -50.68 72.57 Favored 'General case' 0 CA--C 1.519 -0.226 0 C-N-CA 123.853 0.861 . . . . 0.0 110.605 175.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.6 t -65.99 -30.52 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-O 119.49 -0.29 . . . . 0.0 111.218 -178.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.455 ' CZ ' ' HA ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -66.5 -48.84 68.54 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 118.077 -0.964 . . . . 0.0 108.725 175.764 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.455 ' HA ' ' CZ ' ' A' ' 21' ' ' ARG . 7.5 t70 -62.16 140.53 58.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 123.981 0.801 . . . . 0.0 112.289 -175.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -78.75 -19.51 52.13 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 117.566 -1.207 . . . . 0.0 113.691 -175.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -105.99 -1.66 39.14 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 118.846 -0.975 . . . . 0.0 114.096 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.7 t -71.74 147.95 46.85 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.365 1.582 . . . . 0.0 109.133 176.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.88 -33.11 59.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.328 176.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.7 t -74.79 123.48 30.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 175.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.2 pp -114.64 -23.89 4.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 C-N-CA 124.289 1.035 . . . . 0.0 110.874 -178.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.405 ' CZ2' ' HA3' ' A' ' 45' ' ' GLY . 34.3 p-90 -124.64 144.98 49.89 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 123.632 0.773 . . . . 0.0 109.194 178.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.49 HG21 ' HB1' ' A' ' 16' ' ' ALA . 5.8 t -135.68 161.93 37.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 127.113 2.165 . . . . 0.0 107.594 176.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 63' ' ' ALA . 72.3 p -125.55 157.83 36.1 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 175.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -127.5 123.71 36.57 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 176.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -94.46 176.01 6.46 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.44 ' CE2' HD12 ' A' ' 39' ' ' ILE . 21.7 m-85 -119.65 137.5 53.84 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 175.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -137.47 123.97 20.86 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 50.67 -110.88 1.03 Allowed Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.5 p -110.71 27.39 9.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.648 1.579 . . . . 0.0 112.56 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.7 t -148.07 172.6 14.01 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 119.25 0.932 . . . . 0.0 113.143 176.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.581 HG12 HG22 ' A' ' 8' ' ' ILE . 7.8 mm -99.0 134.19 38.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 N-CA-C 105.063 -2.199 . . . . 0.0 105.063 175.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.1 m -127.66 159.62 65.08 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 123.186 0.594 . . . . 0.0 111.262 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.99 144.19 57.27 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 121.809 1.673 . . . . 0.0 110.428 175.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -113.83 -155.05 11.4 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 125.827 1.679 . . . . 0.0 110.078 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -63.56 159.61 18.38 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.688 1.195 . . . . 0.0 110.808 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -143.96 165.97 26.27 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 125.523 1.529 . . . . 0.0 109.043 176.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.405 ' HA3' ' CZ2' ' A' ' 29' ' ' TRP . . . -178.51 -175.65 45.78 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 124.016 0.817 . . . . 0.0 111.818 -176.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -118.39 -22.7 7.51 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.215 1.406 . . . . 0.0 112.465 -176.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -115.07 130.5 56.95 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 -176.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -83.04 -7.57 59.64 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.042 0.837 . . . . 0.0 111.456 -175.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -54.23 -37.16 64.3 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.283 -1.511 . . . . 0.0 111.69 175.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -70.11 -26.86 64.16 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.829 1.252 . . . . 0.0 112.444 177.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -62.49 -46.61 87.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.472 1.509 . . . . 0.0 109.477 -177.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.9 mp -61.12 -42.07 91.8 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -177.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -65.57 -24.01 66.98 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.369 0.531 . . . . 0.0 112.425 176.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -80.93 -23.9 38.56 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.842 1.201 . . . . 0.0 112.251 176.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 99.1 m -60.16 123.56 17.54 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 104.284 -2.488 . . . . 0.0 104.284 175.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.509 ' OG1' HG22 ' A' ' 59' ' ' VAL . 72.7 p -82.84 174.04 11.3 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -174.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -60.76 -76.55 0.05 OUTLIER 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 127.433 2.293 . . . . 0.0 109.424 176.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -106.4 -36.53 6.79 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -175.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.509 HG22 ' OG1' ' A' ' 56' ' ' THR . 1.5 m -60.62 165.7 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.343 0.293 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -174.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 28.1 ptt-85 -103.77 151.62 22.83 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 175.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 60.8 tp -148.65 161.53 41.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -127.16 151.07 49.16 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.481 ' HA ' ' HA ' ' A' ' 31' ' ' THR . . . -145.58 157.87 43.92 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.088 0.555 . . . . 0.0 111.842 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.419 ' CE1' HG13 ' A' ' 108' ' ' VAL . 34.0 t80 -131.37 123.78 28.95 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 -178.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 39.6 t -137.67 141.63 38.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 -175.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.2 ttp-105 -83.99 138.31 33.18 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 175.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -136.13 153.58 51.25 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 125.474 1.509 . . . . 0.0 107.837 -177.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 92.3 m -123.01 113.31 18.89 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 121.124 -0.985 . . . . 0.0 109.122 -179.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.8 m -156.67 141.11 16.7 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 72.46 113.65 0.06 OUTLIER Glycine 0 CA--C 1.507 -0.417 0 N-CA-C 106.189 -2.764 . . . . 0.0 106.189 -175.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -123.9 176.27 6.42 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 126.015 1.726 . . . . 0.0 111.643 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -141.98 -173.1 3.72 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 129.398 3.079 . . . . 0.0 106.304 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -55.88 0.46 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.467 1.507 . . . . 0.0 113.559 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 66.5 m -146.4 152.65 39.41 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 128.622 2.769 . . . . 0.0 105.4 175.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -61.32 155.4 21.36 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.583 0.706 . . . . 0.0 109.847 -177.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 46.6 mtp180 -133.55 176.32 8.65 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 126.044 1.738 . . . . 0.0 109.351 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 8.5 t -142.35 160.17 40.79 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 124.473 1.109 . . . . 0.0 110.109 -176.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -145.06 171.57 14.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 130.852 3.661 . . . . 0.0 106.608 176.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -143.18 143.44 31.78 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 175.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -117.57 118.3 31.77 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 178.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -87.88 113.7 23.79 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 101.988 -3.338 . . . . 0.0 101.988 175.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.6 mp -101.31 143.14 14.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 -176.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 2.6 m -125.69 123.58 39.23 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 175.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -93.37 123.72 36.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 104.868 -2.271 . . . . 0.0 104.868 175.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.8 mt -143.12 92.29 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -58.93 156.11 24.84 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 108.308 -1.917 . . . . 0.0 108.308 175.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -74.33 -4.43 36.25 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 119.997 -1.884 . . . . 0.0 111.084 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -83.83 -36.4 23.52 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 121.254 -0.904 . . . . 0.0 110.771 -175.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.5 p -64.45 128.99 27.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 175.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.4 t -60.5 154.33 21.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.527 1.156 . . . . 0.0 111.745 -175.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -53.67 -30.84 44.19 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 125.59 1.567 . . . . 0.0 113.179 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.6 tt -62.97 -41.44 99.55 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.489 1.116 . . . . 0.0 111.12 178.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -76.92 -41.24 44.29 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.45 -35.0 62.53 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.64 1.109 . . . . 0.0 109.806 175.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.37 -30.25 64.72 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 119.877 1.217 . . . . 0.0 113.412 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 23.7 mmtp -57.88 -31.91 67.17 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 119.384 0.993 . . . . 0.0 110.833 175.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.5 m -56.65 -33.98 66.87 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.493 1.042 . . . . 0.0 109.933 -178.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.23 -14.97 67.14 Favored Glycine 0 CA--C 1.535 1.324 0 CA-C-O 119.143 -0.81 . . . . 0.0 113.834 177.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.8 m -112.32 -4.62 14.27 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 127.684 2.394 . . . . 0.0 110.245 176.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -104.48 -35.36 7.92 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 124.257 1.023 . . . . 0.0 111.532 -175.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -59.6 -34.71 73.09 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.108 -0.995 . . . . 0.0 111.058 -177.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 7.0 t -66.98 -33.87 76.52 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.804 1.241 . . . . 0.0 110.369 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.538 ' O ' HG21 ' A' ' 8' ' ' ILE . 13.2 mt -70.91 -63.29 1.13 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.687 1.195 . . . . 0.0 108.88 -176.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . 0.267 0.9 OUTLIER -59.46 -25.2 30.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-O 117.909 -1.043 . . . . 0.0 109.537 175.562 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -61.8 -41.97 98.42 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 120.909 1.686 . . . . 0.0 108.818 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -51.03 -31.03 17.08 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 120.704 1.593 . . . . 0.0 111.75 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 96.4 t -85.32 -63.57 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 124.685 1.194 . . . . 0.0 108.096 175.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.419 HG13 ' CE1' ' A' ' 64' ' ' PHE . 45.0 t -71.14 26.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 C-N-CA 130.566 3.546 . . . . 0.0 112.824 -175.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -57.63 -26.96 62.35 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.776 -1.828 . . . . 0.0 113.525 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -91.56 79.87 5.45 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 175.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -144.0 165.05 28.84 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 123.225 0.61 . . . . 0.0 109.569 177.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.63 -66.63 0.89 Allowed 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.36 175.72 12.8 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 126.451 1.901 . . . . 0.0 109.176 -175.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -115.41 164.51 14.17 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 123.429 0.456 . . . . 0.0 110.67 175.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -139.95 142.22 36.39 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 102.659 -3.089 . . . . 0.0 102.659 -175.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.34 128.5 73.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 176.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 2.6 mp -128.25 145.14 35.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 C-N-CA 125.985 1.714 . . . . 0.0 106.796 -176.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 42.0 p -131.31 -7.07 3.79 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.558 1.143 . . . . 0.0 113.464 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -116.73 130.08 56.51 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 15.2 ttp-105 -72.88 -28.54 62.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 118.61 -0.71 . . . . 0.0 111.964 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -69.89 -45.79 66.88 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 119.503 1.047 . . . . 0.0 109.017 175.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -53.55 -47.36 70.09 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 124.434 1.094 . . . . 0.0 110.16 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -43.91 -24.11 0.12 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 128.483 2.713 . . . . 0.0 116.793 -175.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -44.6 143.38 1.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 124.097 0.959 . . . . 0.0 110.636 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -60.33 -21.19 61.75 Favored 'General case' 0 C--N 1.341 0.213 0 O-C-N 121.587 -0.695 . . . . 0.0 111.024 -178.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -46.1 -59.17 3.03 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 125.34 1.456 . . . . 0.0 112.308 -175.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -81.15 -26.33 36.17 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 115.933 -2.307 . . . . 0.0 109.274 -176.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 36.2 mt -57.83 -44.07 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -60.34 -50.22 74.49 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 123.54 0.736 . . . . 0.0 111.64 -175.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.3 t -75.7 -30.68 59.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.554 0.616 . . . . 0.0 111.368 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -65.09 -46.46 81.02 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.044 -1.035 . . . . 0.0 108.922 176.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.3 mt -65.64 -26.16 67.69 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 124.084 0.954 . . . . 0.0 111.648 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 30.5 mmtm -63.59 -60.54 3.2 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 175.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? -53.82 -57.36 11.19 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 123.652 0.595 . . . . 0.0 110.474 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.21 -24.72 66.54 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -176.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.82 -2.96 83.81 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.743 1.639 . . . . 0.0 113.677 177.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 106.89 -5.43 36.73 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 125.595 1.569 . . . . 0.0 114.337 175.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -85.37 86.01 7.4 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 119.69 1.745 . . . . 0.0 108.03 176.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -144.49 107.4 4.49 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 105.683 -1.969 . . . . 0.0 105.683 176.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -142.71 116.23 9.12 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 -175.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -116.57 117.28 29.44 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 104.637 -2.357 . . . . 0.0 104.637 175.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -147.12 136.05 22.28 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 127.435 2.294 . . . . 0.0 105.18 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -144.65 140.5 28.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 -175.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 m 86.3 55.88 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 128.207 2.603 . . . . 0.0 109.66 -178.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 . . . . . 0 C--O 1.249 1.076 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 175.575 . . . . . . . . 0 0 . 1 stop_ save_