data_5j8h_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 5j8h _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 4' ' ' LEU . . . . . . . . . . . . . 2.8 mm? . . . . . 0 N--CA 1.395 -3.203 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.46 ' O ' HG13 ' A' ' 9' ' ' ILE . 27.0 p -88.1 170.09 11.37 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 174.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -64.93 -43.82 91.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -174.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -64.89 -36.56 84.74 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.838 0.827 . . . . 0.0 108.987 178.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.414 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 6.0 tp-100 -62.39 -50.27 72.21 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.349 -1.296 . . . . 0.0 108.983 178.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 5' ' ' THR . 82.5 mt -59.14 -39.7 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.571 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.5 -34.66 77.3 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.151 0.501 . . . . 0.0 111.466 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -74.42 -36.59 63.44 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.414 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 23.7 m-85 -69.19 -31.59 70.31 Favored 'General case' 0 C--O 1.2 -1.509 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.861 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -55.43 -48.18 74.83 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 172.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.425 ' O ' HD13 ' A' ' 18' ' ' LEU . 40.8 tt0 -60.81 -58.86 6.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.37 178.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.34 -48.34 62.45 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.381 0.672 . . . . 0.0 111.117 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.429 ' HZ ' ' O ' ' A' ' 25' ' ' GLY . 64.2 t80 -56.1 -44.88 79.48 Favored 'General case' 0 C--O 1.213 -0.816 0 C-N-CA 124.312 1.045 . . . . 0.0 110.892 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.4 m -73.47 -27.44 61.4 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.723 -177.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.425 HD13 ' O ' ' A' ' 14' ' ' GLU . 8.6 mp -66.62 -34.07 77.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.009 0.433 . . . . 0.0 111.564 176.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -87.74 -36.59 17.26 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.901 176.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -76.85 87.98 3.44 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-O 122.12 0.962 . . . . 0.0 109.931 176.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.491 ' HE3' ' CG2' ' A' ' 34' ' ' THR . 61.5 mttm -68.66 -28.36 66.81 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.574 -1.193 . . . . 0.0 112.655 -175.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.532 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 23.9 m-20 -82.84 -14.12 54.92 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.541 -0.864 . . . . 0.0 110.539 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.85 44.42 97.09 Favored Glycine 0 CA--C 1.517 0.205 0 O-C-N 123.353 0.408 . . . . 0.0 112.082 -178.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.532 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 4.6 p30 -113.18 -16.45 12.57 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 120.797 0.332 . . . . 0.0 111.018 -176.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.429 ' O ' ' HZ ' ' A' ' 16' ' ' PHE . . . 102.32 4.42 50.17 Favored Glycine 0 N--CA 1.431 -1.646 0 C-N-CA 120.014 -1.088 . . . . 0.0 114.666 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.9 p -138.63 130.77 28.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 118.33 1.065 . . . . 0.0 110.769 172.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 56.6 mt -93.1 128.68 44.43 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 C-N-CA 122.371 0.269 . . . . 0.0 110.368 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 p -101.47 171.51 7.53 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 123.635 0.774 . . . . 0.0 110.149 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 47.1 p -69.19 -24.84 64.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.273 0.559 . . . . 0.0 109.907 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -57.63 -53.08 62.2 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.236 175.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -67.66 -42.8 81.59 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 114.124 -1.398 . . . . 0.0 110.723 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.1 mt -59.67 -54.19 49.25 Favored 'General case' 0 C--O 1.204 -1.303 0 O-C-N 123.767 0.667 . . . . 0.0 110.314 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.91 -27.99 69.54 Favored Glycine 0 C--N 1.313 -0.741 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.035 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.491 ' CG2' ' HE3' ' A' ' 21' ' ' LYS . 58.0 m -75.6 -43.15 49.61 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 116.941 0.371 . . . . 0.0 110.804 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 31.5 m -68.5 -33.98 63.0 Favored 'Isoleucine or valine' 0 C--N 1.344 0.34 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.487 178.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -65.5 -40.63 93.25 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.262 173.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -59.8 -48.07 83.15 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 123.137 0.575 . . . . 0.0 110.072 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.3 m -69.51 -21.1 63.7 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.305 0.574 . . . . 0.0 111.041 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.551 HD13 ' O ' ' A' ' 112' ' ' LEU . 3.4 tm? -83.05 -23.2 33.27 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.73 39.71 3.09 Favored Glycine 0 N--CA 1.433 -1.521 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.512 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.443 ' C ' HD21 ' A' ' 42' ' ' ASN . 35.6 tt0 -143.96 135.58 26.05 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 177.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.443 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.76 84.36 43.56 Favored Pre-proline 0 C--N 1.301 -1.515 0 O-C-N 122.167 -0.333 . . . . 0.0 110.193 176.255 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -76.83 170.87 19.02 Favored 'Trans proline' 0 C--O 1.242 0.721 0 C-N-CA 122.475 2.117 . . . . 0.0 110.163 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.51 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 77.0 p -89.42 164.38 14.88 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.904 -177.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -57.17 -41.66 79.67 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 124.356 1.062 . . . . 0.0 108.45 176.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.92 -42.35 98.98 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.094 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.51 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 7.8 mm-40 -62.92 -47.57 82.69 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 121.211 0.529 . . . . 0.0 110.965 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.4 mt -69.7 -38.12 76.84 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.503 -176.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -64.45 -45.57 86.88 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -61.47 -44.14 97.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.404 177.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 51.3 tpp -55.63 -44.09 76.79 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.016 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.7 mt -65.02 -56.26 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.569 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -58.92 -23.7 61.57 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -172.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -66.5 -38.77 87.97 Favored 'General case' 0 N--CA 1.386 -3.663 0 C-N-CA 123.122 0.569 . . . . 0.0 111.679 175.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.588 HG13 ' SD ' ' A' ' 71' ' ' MET . 8.6 m -95.87 -18.79 6.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 120.838 0.351 . . . . 0.0 110.454 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -70.62 89.84 0.74 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.67 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.37 -27.11 23.0 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.207 -176.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -82.23 -11.71 58.51 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.384 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.08 17.98 79.69 Favored Glycine 0 N--CA 1.434 -1.451 0 CA-C-O 119.457 -0.635 . . . . 0.0 114.228 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.0 p30 -81.39 -16.31 52.59 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.043 1.421 . . . . 0.0 111.871 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.78 4.71 58.94 Favored Glycine 0 N--CA 1.441 -0.968 0 C-N-CA 120.545 -0.836 . . . . 0.0 114.027 177.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.0 p -135.78 166.77 22.52 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 117.909 0.855 . . . . 0.0 111.198 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.3 mt -91.27 111.62 24.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -89.66 161.4 16.13 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 176.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.447 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 37.1 t80 -58.5 -50.11 89.85 Favored Pre-proline 0 CA--C 1.553 1.086 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.5 Cg_endo -49.23 -41.92 41.06 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.853 2.368 . . . . 0.0 112.479 174.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -70.64 -41.06 72.67 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.517 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.23 -45.0 92.31 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.729 174.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.51 -45.7 80.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.338 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.518 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 43.5 m -57.35 -54.32 48.18 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 123.618 0.574 . . . . 0.0 110.816 174.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.588 ' SD ' HG13 ' A' ' 55' ' ' VAL . 35.6 ttp -53.69 -51.72 62.32 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 123.737 0.815 . . . . 0.0 112.035 -178.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 34.2 tpp -67.74 -43.27 80.31 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.65 -28.88 69.7 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 123.726 0.641 . . . . 0.0 111.54 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.518 ' HG3' ' O ' ' A' ' 70' ' ' THR . 51.6 mtp180 -79.21 -36.39 40.23 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.177 177.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -72.79 -30.66 64.27 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 121.465 0.65 . . . . 0.0 110.809 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 56.6 ttp . . . . . 0 C--N 1.308 -1.202 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.684 -176.824 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -51.36 -50.71 58.97 Favored 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.333 0.653 . . . . 0.0 111.778 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 74' ' ' ARG . 8.2 mm-40 -60.03 -35.32 74.84 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.46 -176.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 30.3 mm -74.97 -45.04 43.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.732 -177.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -71.48 -35.86 70.96 Favored 'General case' 0 C--O 1.21 -1.021 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.401 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.402 ' CD ' HH21 ' A' ' 90' ' ' ARG . 5.6 mm-40 -61.91 -35.89 79.7 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.637 0.256 . . . . 0.0 111.597 175.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.445 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -68.64 -44.3 74.46 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 176.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -59.9 -41.67 92.17 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 121.317 0.579 . . . . 0.0 109.533 178.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.402 HH21 ' CD ' ' A' ' 87' ' ' GLU . 7.0 tmm_? -61.7 -36.82 82.0 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 125.356 1.462 . . . . 0.0 111.822 -178.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 88' ' ' ALA . 9.6 p -80.43 -19.01 12.05 Favored 'Isoleucine or valine' 0 C--O 1.248 0.982 0 CA-C-O 121.589 0.709 . . . . 0.0 111.066 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -88.06 -54.3 4.29 Favored 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 120.025 -0.67 . . . . 0.0 111.467 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -104.07 87.57 2.8 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.049 0.452 . . . . 0.0 110.373 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HD3' ' N ' ' A' ' 94' ' ' LYS . 3.3 mppt? -80.11 -28.13 39.06 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.525 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -77.44 -13.24 59.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.127 -171.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.7 62.46 3.01 Favored Glycine 0 N--CA 1.431 -1.645 0 C-N-CA 120.091 -1.052 . . . . 0.0 111.542 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -96.7 -18.64 19.53 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 176.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.86 -5.01 85.9 Favored Glycine 0 N--CA 1.441 -1.0 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.486 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 61.1 m-85 -143.54 143.36 31.5 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 -178.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.3 mt -80.22 125.2 38.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.759 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.6 m -95.57 140.06 30.94 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.13 -40.25 97.05 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.576 0.35 . . . . 0.0 111.532 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.57 -37.06 80.06 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.05 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 67.5 tt0 -77.3 -36.83 53.79 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.662 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.415 ' O ' HG12 ' A' ' 108' ' ' VAL . 7.9 tt -66.55 -36.8 83.56 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.402 ' HB2' HG23 ' A' ' 121' ' ' VAL . 2.7 tmt_? -62.0 -40.82 96.94 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -64.36 -44.95 89.83 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.328 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.556 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.2 p -66.51 -32.3 57.45 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.172 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 20.5 mmt -64.39 -40.12 95.2 Favored 'General case' 0 CA--C 1.5 -0.965 0 N-CA-C 111.89 0.329 . . . . 0.0 111.89 178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.4 m -62.52 -35.85 80.72 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -74.45 -28.94 61.26 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.913 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 70.4 mt -90.64 -14.87 31.49 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 121.139 0.495 . . . . 0.0 110.25 -176.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.58 3.47 86.33 Favored Glycine 0 N--CA 1.436 -1.346 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.889 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.522 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 24.0 mm-40 -70.67 -30.46 67.06 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.981 0.39 . . . . 0.0 110.01 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 51.93 86.6 0.04 OUTLIER 'General case' 0 C--O 1.246 0.91 0 O-C-N 124.594 1.184 . . . . 0.0 112.569 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 62.4 mt -113.05 148.8 34.43 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.217 -178.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 9.4 p -77.09 165.21 24.9 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.993 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.9 -40.29 97.11 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.46 -35.64 81.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.891 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.77 -55.65 16.14 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.701 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.402 HG23 ' HB2' ' A' ' 106' ' ' ARG . 15.1 m -64.16 -33.13 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.421 -178.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -63.85 -43.13 97.07 Favored 'General case' 0 CA--C 1.507 -0.68 0 C-N-CA 123.193 0.597 . . . . 0.0 109.642 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -67.36 -43.66 80.9 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.907 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.8 mtt -57.8 -48.9 78.39 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.941 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.4 mm -64.26 -43.38 97.23 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.579 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.556 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -56.24 -44.32 79.52 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 123.09 0.556 . . . . 0.0 112.182 -176.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -71.56 -31.74 67.32 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 119.924 -0.711 . . . . 0.0 110.88 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.412 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -79.5 -30.51 42.0 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.645 -178.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -72.47 91.91 1.42 Allowed 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 124.454 1.102 . . . . 0.0 108.07 173.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 68.2 mt -81.72 -42.41 19.27 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.786 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.274 -173.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -79.54 -12.05 59.87 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.892 -176.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.35 50.45 5.07 Favored Glycine 0 C--N 1.31 -0.911 0 C-N-CA 120.431 -0.89 . . . . 0.0 113.609 175.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -100.27 -15.54 18.02 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 122.074 0.94 . . . . 0.0 108.51 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 94.5 -0.1 65.33 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.486 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 24.0 mt-30 -142.29 140.92 32.35 Favored 'General case' 0 N--CA 1.429 -1.52 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 -178.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -99.1 122.17 50.54 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -175.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.464 ' ND2' ' HG3' ' A' ' 140' ' ' GLU . 0.5 OUTLIER -85.56 171.75 11.48 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.941 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.591 ' O ' HG11 ' A' ' 142' ' ' VAL . 75.2 t80 -54.57 -47.0 73.81 Favored 'General case' 0 C--O 1.219 -0.502 0 C-N-CA 123.225 0.61 . . . . 0.0 112.325 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.76 -23.67 67.46 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.072 0.463 . . . . 0.0 112.095 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.464 ' HG3' ' ND2' ' A' ' 137' ' ' ASN . 44.5 mt-10 -86.89 -37.86 17.28 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-O 121.713 0.768 . . . . 0.0 108.977 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -70.34 -30.47 67.43 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.3 -0.864 . . . . 0.0 112.102 -179.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.591 HG11 ' O ' ' A' ' 138' ' ' TYR . 28.9 m -59.83 -35.01 57.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -76.96 -34.11 57.62 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.644 0.735 . . . . 0.0 109.41 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.412 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 92.6 mmm -76.24 -35.65 58.88 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.403 -176.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 14.6 tpt . . . . . 0 C--N 1.307 -1.26 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.354 -178.17 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 64.4 tttm . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 111.383 0.142 . . . . 0.0 111.383 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . 0.406 ' O ' ' HB3' ' B' ' 86' ' ' LYS . 1.6 mp0 -66.43 -41.91 88.49 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 178.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -69.8 -41.78 74.58 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.99 0.424 . . . . 0.0 110.47 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 77.3 t-105 -66.31 -22.72 66.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 122.673 1.225 . . . . 0.0 109.196 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . 0.545 ' O ' ' HG3' ' B' ' 90' ' ' GLN . 85.2 tttt -78.97 -63.59 1.38 Allowed 'General case' 0 C--N 1.267 -3.016 0 CA-C-N 115.049 -0.978 . . . . 0.0 108.808 174.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -63.71 -52.14 61.87 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -170.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.12 -29.94 69.82 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.164 0.507 . . . . 0.0 111.126 -176.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 42.8 mm -83.14 -28.62 7.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.22 -178.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . 0.545 ' HG3' ' O ' ' B' ' 86' ' ' LYS . 50.7 mt-30 -62.65 -46.48 88.02 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 174.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . 0.522 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 24.6 tptm -64.68 -25.91 68.15 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.082 -1.417 . . . . 0.0 112.164 -178.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . 0.44 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -76.83 -10.85 59.66 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -176.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 25.3 tptp . . . . . 0 C--N 1.313 -1.006 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -172.195 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.412 ' HB3' HD13 ' A' ' 9' ' ' ILE . 8.9 tp . . . . . 0 N--CA 1.42 -1.963 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.6 p -73.17 151.47 41.5 Favored 'General case' 0 N--CA 1.424 -1.727 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.271 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -53.92 -43.12 69.47 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -173.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -70.0 -33.38 71.96 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.853 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -61.64 -48.89 78.83 Favored 'General case' 0 C--O 1.212 -0.884 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 175.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 43.3 mt -60.51 -33.66 55.25 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.683 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.601 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 13' ' ' LYS . . . -65.29 -41.05 94.53 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.534 0.683 . . . . 0.0 110.25 175.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -65.88 -37.78 87.04 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.355 0.598 . . . . 0.0 109.634 175.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.54 ' HZ ' ' SD ' ' A' ' 76' ' ' MET . 46.4 m-85 -69.67 -25.05 63.71 Favored 'General case' 0 C--O 1.176 -2.791 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.885 177.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 33.1 mmtp -60.28 -47.78 84.56 Favored 'General case' 0 C--O 1.25 1.125 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 172.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.55 -55.39 20.8 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.379 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.89 82.32 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.166 -0.925 . . . . 0.0 113.136 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -65.6 -45.79 81.82 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -69.14 -16.92 63.76 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.681 -177.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.48 -42.27 99.36 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 171.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -81.32 -51.36 8.45 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.825 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -70.64 98.89 1.57 Allowed 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.801 0.81 . . . . 0.0 110.551 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mmtm -77.56 -15.82 59.01 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 114.793 -1.094 . . . . 0.0 113.366 -174.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.478 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 11.1 m-20 -95.42 -14.38 23.84 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.648 -176.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.26 40.34 87.59 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.478 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 5.5 p30 -113.12 -15.23 12.82 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -175.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.23 14.08 60.91 Favored Glycine 0 C--N 1.313 -0.696 0 C-N-CA 120.961 -0.637 . . . . 0.0 113.539 178.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.5 p -134.76 131.39 37.5 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 174.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.8 mt -104.72 121.34 56.45 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.3 p -92.74 171.99 8.64 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.689 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.7 p -59.81 -35.34 74.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.558 0.694 . . . . 0.0 109.648 176.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -54.43 -51.0 66.33 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.109 1.364 . . . . 0.0 110.506 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -70.84 -36.38 72.86 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.272 -175.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 85.5 mt -61.65 -51.22 69.36 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 175.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.1 -29.45 74.45 Favored Glycine 0 N--CA 1.441 -1.021 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.428 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -61.18 -53.28 58.88 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 116.975 0.388 . . . . 0.0 110.433 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.9 m -71.02 -31.54 45.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.349 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.442 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 64.9 mtt -68.14 -37.74 81.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.221 177.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -65.11 -31.9 73.34 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 177.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.6 m -75.33 -13.86 60.44 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.545 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -104.57 6.14 34.35 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.167 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.02 23.14 64.32 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 116.0 -0.545 . . . . 0.0 113.524 178.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.459 ' HG3' ' HD3' ' A' ' 43' ' ' PRO . 5.4 tp-100 -120.8 131.53 54.51 Favored 'General case' 0 N--CA 1.424 -1.754 0 O-C-N 122.226 -0.573 . . . . 0.0 110.474 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.428 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -123.29 79.32 53.11 Favored Pre-proline 0 C--N 1.296 -1.737 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.441 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.459 ' HD3' ' HG3' ' A' ' 41' ' ' GLN . 31.8 Cg_exo -65.89 164.24 27.89 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 122.188 1.925 . . . . 0.0 110.84 176.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.417 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 46.9 p -76.75 166.02 23.94 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 -179.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -60.07 -36.47 77.42 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.89 -45.78 93.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.66 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.417 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 34.1 mm-40 -60.49 -43.45 96.98 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.443 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.05 -46.8 76.49 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.95 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 47.1 tp60 -68.64 -42.65 77.68 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -61.39 -42.24 98.4 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.375 0.607 . . . . 0.0 109.854 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 45.0 ttm -54.31 -46.85 72.91 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.506 177.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 40.2 mt -67.54 -53.61 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.178 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -54.99 -27.54 44.98 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -172.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -66.65 -42.3 86.87 Favored 'General case' 0 N--CA 1.386 -3.658 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 178.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.44 HG13 ' SD ' ' A' ' 71' ' ' MET . 4.3 m -94.82 -14.59 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-O 120.863 0.363 . . . . 0.0 111.321 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -69.28 104.83 2.33 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.54 -35.61 22.74 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.364 -173.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -91.01 -10.55 41.86 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.593 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.65 52.21 36.06 Favored Glycine 0 C--O 1.239 0.429 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.768 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -107.69 -13.89 14.93 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.537 0.208 . . . . 0.0 111.452 -178.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.9 -3.27 33.79 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.239 -0.982 . . . . 0.0 113.563 179.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.9 p -127.83 151.25 49.28 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 117.504 0.652 . . . . 0.0 110.84 178.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.1 mt -91.58 104.69 15.78 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.086 0 N-CA-C 104.198 -2.519 . . . . 0.0 104.198 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.13 158.82 20.29 Favored 'General case' 0 C--N 1.283 -2.303 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -175.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.429 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 52.0 t80 -51.46 -51.69 66.85 Favored Pre-proline 0 CA--C 1.554 1.122 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -176.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.429 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 8.5 Cg_endo -50.52 -44.57 39.18 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.774 2.316 . . . . 0.0 112.838 175.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -69.04 -36.94 78.27 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.537 0.684 . . . . 0.0 110.304 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -63.54 -39.64 94.94 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.092 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 87.2 mt -65.86 -44.02 86.67 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.141 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 93.2 m -54.99 -49.12 72.27 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 123.867 0.73 . . . . 0.0 109.656 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.44 ' SD ' HG13 ' A' ' 55' ' ' VAL . 17.9 ttp -54.41 -52.76 60.71 Favored 'General case' 0 C--O 1.199 -1.591 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.861 176.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.438 ' HE3' ' HE3' ' A' ' 71' ' ' MET . 23.0 mmt -64.23 -42.67 96.46 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -174.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.39 -35.25 71.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.625 0.726 . . . . 0.0 110.486 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 -83.8 -32.79 25.16 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.126 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -83.29 -35.57 25.17 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 123.077 0.551 . . . . 0.0 112.22 -168.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.54 ' SD ' ' HZ ' ' A' ' 12' ' ' PHE . 63.6 mtm . . . . . 0 C--N 1.308 -1.226 0 CA-C-O 121.489 0.662 . . . . 0.0 110.542 -178.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 . . . . . 0 N--CA 1.467 0.398 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -64.73 -27.45 68.92 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 121.056 0.455 . . . . 0.0 111.542 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.66 -27.25 55.54 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.858 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 27.2 mm -72.32 -38.61 61.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 174.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 86' ' ' ARG . 49.2 ttp180 -61.74 -42.77 99.4 Favored 'General case' 0 C--O 1.21 -0.996 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.296 174.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -56.33 -51.75 67.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.04 -43.64 91.68 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.197 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.36 -54.02 49.18 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.68 -43.67 69.09 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 125.166 1.386 . . . . 0.0 112.707 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 11.9 p -72.15 -25.94 24.28 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.536 -176.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -82.06 -56.07 4.18 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 175.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -84.23 85.07 7.41 Favored 'General case' 0 C--O 1.252 1.212 0 CA-C-O 122.124 0.964 . . . . 0.0 110.663 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -78.65 -35.02 45.97 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 114.447 -1.251 . . . . 0.0 112.798 -178.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -73.32 -13.57 61.14 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 121.186 0.517 . . . . 0.0 111.003 -178.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.63 52.6 9.62 Favored Glycine 0 N--CA 1.43 -1.715 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -87.94 -18.62 28.72 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.22 6.07 88.34 Favored Glycine 0 CA--C 1.501 -0.805 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.47 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 98.5 m-85 -147.34 149.85 33.6 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 -178.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.411 ' HB ' HG12 ' A' ' 136' ' ' VAL . 3.9 mt -93.48 123.3 45.52 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.875 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 175.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 29.9 t -104.06 151.94 22.65 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 123.723 0.809 . . . . 0.0 109.451 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.31 -34.91 79.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.776 178.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.25 86.23 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.089 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.555 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 2.1 tp10 -68.33 -41.17 81.19 Favored 'General case' 0 CA--C 1.503 -0.856 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.437 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -61.43 -39.32 90.37 Favored 'General case' 0 N--CA 1.427 -1.601 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -175.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.581 ' HG3' HG23 ' A' ' 121' ' ' VAL . 19.5 mtm180 -56.65 -42.8 79.57 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.401 172.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . 0.555 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 50.3 m170 -54.52 -56.04 22.97 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.584 0.753 . . . . 0.0 110.697 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 6.2 p -70.94 -35.65 60.5 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.137 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.187 -174.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 22.7 mmt -63.49 -45.28 91.44 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -177.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.8 p -65.23 -36.01 82.82 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-O 121.135 0.493 . . . . 0.0 110.129 176.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -66.0 -32.58 74.14 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.696 178.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 78.9 mt -85.05 -17.91 36.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.824 -177.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 80.33 23.84 60.16 Favored Glycine 0 N--CA 1.435 -1.414 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.451 -177.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -84.99 -35.22 22.11 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 55.4 tptt 47.58 88.25 0.02 OUTLIER 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.648 1.579 . . . . 0.0 113.611 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 64.6 mt -101.06 155.63 17.88 Favored 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 24.3 p -75.78 166.09 24.06 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 175.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -63.52 -34.14 77.14 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -64.13 -44.58 91.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.159 176.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -70.5 -35.66 73.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.855 -174.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.581 HG23 ' HG3' ' A' ' 106' ' ' ARG . 19.2 m -72.52 -33.27 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.897 176.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -70.94 -41.86 70.57 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.284 -177.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -68.55 -31.08 70.04 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.016 177.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.4 mtt -58.8 -48.53 80.96 Favored 'General case' 0 CA--C 1.497 -1.071 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.263 175.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.11 -46.57 96.18 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.533 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.656 178.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -55.67 -44.41 77.26 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.25 0.62 . . . . 0.0 111.48 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -66.17 -28.82 69.07 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.094 0.558 . . . . 0.0 111.37 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -97.52 -20.57 17.64 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.624 -0.431 . . . . 0.0 112.05 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.411 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 5.4 t70 -70.24 93.22 0.82 Allowed 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 124.052 0.941 . . . . 0.0 110.244 177.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.1 mt -84.53 -40.31 15.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.229 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -83.76 -10.99 57.72 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.259 0.552 . . . . 0.0 112.305 -172.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.411 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 75.64 55.75 4.87 Favored Glycine 0 C--N 1.307 -1.083 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.587 176.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -111.84 -17.08 13.02 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 177.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.32 4.62 60.94 Favored Glycine 0 N--CA 1.439 -1.136 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.47 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 26.7 mt-30 -147.76 145.12 28.69 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.411 HG12 ' HB ' ' A' ' 100' ' ' ILE . 1.0 OUTLIER -102.81 120.4 52.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -176.094 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -86.05 168.3 14.22 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.427 ' O ' HG12 ' A' ' 142' ' ' VAL . 68.2 t80 -55.62 -46.83 77.33 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.971 0.909 . . . . 0.0 112.852 -174.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -67.45 -26.61 66.48 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -178.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -73.62 -44.87 55.88 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -63.95 -38.7 92.04 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.759 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 138' ' ' TYR . 15.9 m -66.85 -35.02 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.633 177.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -72.73 -37.98 67.56 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -72.54 -50.88 22.6 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.917 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.881 0 C-N-CA 123.167 0.587 . . . . 0.0 110.548 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 84.2 tttt . . . . . 0 C--O 1.238 0.466 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -77.16 -45.08 27.94 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 175.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.73 -49.98 74.76 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.512 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -60.22 -38.14 82.47 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -63.38 -29.97 71.18 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 121.364 0.602 . . . . 0.0 110.897 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -84.12 -43.56 14.91 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.091 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.0 -56.76 18.05 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 123.732 0.813 . . . . 0.0 112.312 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 74.2 mt -62.15 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.086 0.469 . . . . 0.0 110.672 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -66.64 -36.31 82.28 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.286 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -73.16 -38.58 66.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.37 -41.2 94.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.978 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 121.079 0.466 . . . . 0.0 110.034 176.267 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.491 ' HB3' ' HB2' ' A' ' 8' ' ' GLN . 2.9 mm? . . . . . 0 N--CA 1.416 -2.156 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.432 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 25.0 p -79.96 160.89 25.78 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -62.19 -31.4 71.91 Favored 'General case' 0 C--O 1.203 -1.375 0 C-N-CA 121.218 -0.193 . . . . 0.0 110.754 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.41 -42.34 98.76 Favored 'General case' 0 C--N 1.314 -0.974 0 O-C-N 123.5 0.5 . . . . 0.0 111.057 177.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.491 ' HB2' ' HB3' ' A' ' 4' ' ' LEU . 27.6 mm-40 -64.67 -47.9 76.73 Favored 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.8 mt -56.8 -39.33 63.58 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.31 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.4 89.58 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 123.521 0.728 . . . . 0.0 111.069 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -61.85 -44.34 97.03 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.554 0.692 . . . . 0.0 109.444 176.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -68.28 -29.76 68.62 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.444 -178.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -68.42 -33.54 74.39 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.982 175.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -68.49 -50.03 55.36 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.7 -43.09 72.2 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.771 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.411 ' HZ ' ' C ' ' A' ' 25' ' ' GLY . 70.2 t80 -59.17 -44.0 92.14 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.777 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.5 m -74.52 -20.87 59.81 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.733 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.256 2.9 tm? -68.67 -50.65 49.38 Favored 'General case' 0 CA--C 1.483 -1.63 0 N-CA-C 106.198 -1.779 . . . . 0.0 106.198 175.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.43 ' CZ ' HD23 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -77.39 -41.1 41.35 Favored 'General case' 0 N--CA 1.383 -3.809 0 CA-C-N 111.616 -2.538 . . . . 0.0 111.62 -167.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -69.97 96.28 1.02 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -74.13 -36.95 64.22 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.192 -0.913 . . . . 0.0 113.291 -174.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -93.08 -13.57 28.4 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.231 -177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.07 57.4 8.64 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 121.313 -0.47 . . . . 0.0 113.593 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -113.74 -11.96 12.84 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 116.913 0.356 . . . . 0.0 111.053 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.411 ' C ' ' HZ ' ' A' ' 16' ' ' PHE . . . 102.66 5.75 47.73 Favored Glycine 0 N--CA 1.43 -1.704 0 C-N-CA 119.833 -1.175 . . . . 0.0 113.118 -178.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.0 p -145.57 156.39 43.66 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 117.721 0.761 . . . . 0.0 111.011 173.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 72.5 mt -107.56 109.12 27.04 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.6 p -84.96 167.93 15.44 Favored 'General case' 0 C--N 1.288 -2.072 0 O-C-N 122.202 -0.312 . . . . 0.0 110.962 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -56.56 -34.36 67.03 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 123.304 0.642 . . . . 0.0 111.226 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.405 ' HZ2' ' CD ' ' A' ' 45' ' ' GLU . 49.2 mmtm -59.65 -42.15 92.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.819 178.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -70.25 -33.31 71.46 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.933 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.43 HD23 ' CZ ' ' A' ' 19' ' ' PHE . 65.2 mt -56.25 -59.73 4.52 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 174.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.14 -26.8 64.1 Favored Glycine 0 C--O 1.19 -2.652 0 CA-C-N 114.599 -1.182 . . . . 0.0 112.968 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.4 m -65.24 -53.55 42.66 Favored 'General case' 0 CA--C 1.558 1.286 0 CA-C-N 117.734 0.767 . . . . 0.0 110.705 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.1 m -72.27 -32.56 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.32 0.581 . . . . 0.0 109.861 -178.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.41 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 66.9 mtp -72.33 -29.24 63.64 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.589 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -68.15 -36.12 79.15 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 175.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -63.43 -27.46 69.3 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.02 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.426 HD13 ' HD2' ' B' ' 91' ' ' LYS . 4.6 mm? -85.51 -13.54 48.71 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.105 0.478 . . . . 0.0 111.052 177.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.14 16.81 36.74 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.153 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -106.16 130.56 54.02 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -124.38 83.99 56.84 Favored Pre-proline 0 C--N 1.3 -1.545 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.965 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.454 ' HG2' HD21 ' A' ' 48' ' ' LEU . 6.2 Cg_endo -85.73 164.55 10.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.46 2.107 . . . . 0.0 111.117 173.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.0 p -86.9 169.13 12.78 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 120.932 0.396 . . . . 0.0 111.349 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.405 ' CD ' ' HZ2' ' A' ' 30' ' ' LYS . 16.7 tp10 -58.71 -45.58 89.24 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 125.275 1.43 . . . . 0.0 110.229 -176.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.88 95.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.512 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 51' ' ' MET . 40.0 mt-10 -61.67 -47.22 86.34 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.006 0.432 . . . . 0.0 110.128 178.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.454 HD21 ' HG2' ' A' ' 43' ' ' PRO . 95.8 mt -64.82 -38.39 90.82 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.755 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -61.1 -46.05 92.21 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.993 176.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -62.8 -39.93 95.79 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 123.37 0.419 . . . . 0.0 111.241 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.439 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 67.9 mtt -60.78 -45.76 93.11 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.024 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 23.4 mt -73.48 -36.81 49.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.77 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -57.9 -22.46 48.58 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 123.086 0.554 . . . . 0.0 112.346 -176.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -64.09 -32.82 74.52 Favored 'General case' 0 N--CA 1.386 -3.651 0 C-N-CA 124.261 1.024 . . . . 0.0 111.398 176.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.469 ' CG1' ' HB2' ' A' ' 71' ' ' MET . 10.9 m -107.53 -22.81 4.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-O 121.259 0.552 . . . . 0.0 110.086 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -73.08 116.02 13.11 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.48 -174.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.4 -16.07 38.38 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.673 177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -88.88 -11.08 45.65 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.081 -175.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 56.32 29.79 57.29 Favored Glycine 0 CA--C 1.525 0.664 0 CA-C-N 115.479 -0.782 . . . . 0.0 113.354 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 37.2 p30 -116.33 -12.8 11.07 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 108.78 24.69 5.98 Favored Glycine 0 N--CA 1.44 -1.068 0 C-N-CA 119.489 -1.339 . . . . 0.0 113.582 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.3 p -120.24 131.6 55.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 117.581 0.691 . . . . 0.0 111.814 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.9 mt -94.67 110.21 23.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 170.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -90.98 158.01 16.96 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 178.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.455 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 21.9 t80 -55.8 -47.84 97.86 Favored Pre-proline 0 CA--C 1.555 1.172 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -176.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.5 Cg_endo -50.28 -44.6 37.92 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.607 2.205 . . . . 0.0 112.173 172.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -67.08 -42.3 84.88 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.752 0.421 . . . . 0.0 110.219 -179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.51 -50.41 71.88 Favored 'General case' 0 C--O 1.244 0.79 0 C-N-CA 124.358 1.063 . . . . 0.0 109.55 176.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.4 mt -61.04 -40.75 94.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.764 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.0 m -59.26 -48.01 83.22 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.566 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.469 ' HB2' ' CG1' ' A' ' 55' ' ' VAL . 29.9 ttp -57.89 -49.99 74.84 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.938 178.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 24.4 mmt -67.39 -43.42 81.39 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 120.252 -0.579 . . . . 0.0 112.43 -176.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.48 -31.36 70.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.041 0.448 . . . . 0.0 111.216 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -80.75 -40.89 24.41 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-O 121.023 0.439 . . . . 0.0 110.871 176.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -77.99 -38.07 45.8 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.146 0.498 . . . . 0.0 110.444 -169.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 46.7 mtm . . . . . 0 C--N 1.318 -0.761 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.048 -179.488 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.437 -1.081 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -64.35 -42.48 96.22 Favored 'General case' 0 CA--C 1.507 -0.691 0 C-N-CA 120.074 -0.65 . . . . 0.0 110.126 172.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -58.07 -40.11 80.22 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.887 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 44.9 mm -67.4 -44.51 86.93 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.172 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -71.7 -39.78 69.96 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.491 -178.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -64.82 -40.66 95.56 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 120.827 0.346 . . . . 0.0 110.876 177.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.418 ' HB3' HD12 ' B' ' 89' ' ' ILE . . . -68.02 -35.94 79.13 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.241 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -65.62 -48.58 71.75 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -55.42 -32.63 62.84 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 179.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.403 HG11 ' O ' ' A' ' 88' ' ' ALA . 13.8 p -74.62 -28.84 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.334 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.505 ' O ' ' HG2' ' A' ' 104' ' ' GLU . 88.3 m-85 -89.19 -35.56 16.15 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.417 0.627 . . . . 0.0 110.23 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -88.82 69.31 8.63 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 174.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -66.6 -34.51 78.04 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 113.821 -1.536 . . . . 0.0 112.771 -171.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -90.22 -7.18 54.18 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.422 0.629 . . . . 0.0 110.476 -176.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.06 55.91 6.78 Favored Glycine 0 CA--C 1.502 -0.764 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -104.19 -18.59 14.44 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.973 0.416 . . . . 0.0 110.181 -175.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.9 10.56 66.58 Favored Glycine 0 N--CA 1.436 -1.36 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.036 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -156.32 141.49 17.38 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 120.851 0.357 . . . . 0.0 110.739 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.4 ' HB ' HG11 ' A' ' 136' ' ' VAL . 2.1 mt -97.49 137.02 26.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.241 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 61.9 p -114.99 158.16 22.44 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.496 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.45 -34.84 78.84 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 121.075 0.464 . . . . 0.0 109.879 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.89 -52.01 67.27 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.859 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.686 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 41.1 tp10 -65.61 -43.3 90.03 Favored 'General case' 0 CA--C 1.482 -1.636 0 C-N-CA 120.424 -0.51 . . . . 0.0 111.554 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.1 tt -57.38 -39.28 75.72 Favored 'General case' 0 N--CA 1.423 -1.814 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 -173.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.464 ' HG3' HG23 ' A' ' 121' ' ' VAL . 52.8 mtp180 -65.77 -34.66 78.69 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 173.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . 0.686 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 30.7 m170 -58.98 -55.57 33.46 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.659 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -64.81 -37.74 80.95 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.392 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.732 -176.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.482 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.2 mmt -60.3 -37.94 82.12 Favored 'General case' 0 C--O 1.251 1.149 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 65.1 m -62.25 -40.58 96.67 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.18 177.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.95 -17.06 53.94 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.251 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.659 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 97.2 mt -92.18 -14.1 29.59 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 121.2 0.524 . . . . 0.0 111.83 -176.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 82.2 6.1 89.08 Favored Glycine 0 N--CA 1.437 -1.274 0 C-N-CA 120.272 -0.966 . . . . 0.0 111.418 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.405 ' HB2' ' SD ' ' A' ' 109' ' ' MET . 47.2 mm-40 -73.2 -44.08 60.33 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 67.1 mttm 57.58 90.74 0.04 OUTLIER 'General case' 0 C--O 1.242 0.668 0 O-C-N 124.763 1.29 . . . . 0.0 111.026 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 76.4 mt -125.89 131.28 52.38 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 17.5 p -83.05 176.89 8.88 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.638 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -60.22 -27.74 67.44 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -172.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -68.75 -51.3 42.67 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 118.825 0.739 . . . . 0.0 111.011 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -58.19 -49.78 75.83 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.945 -177.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.464 HG23 ' HG3' ' A' ' 106' ' ' ARG . 4.3 m -69.99 -29.03 38.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.845 -176.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -65.08 -46.95 79.02 Favored 'General case' 0 CA--C 1.485 -1.52 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -63.17 -36.73 84.59 Favored 'General case' 0 N--CA 1.443 -0.79 0 O-C-N 124.157 0.911 . . . . 0.0 109.79 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.9 mtt -59.88 -49.83 76.16 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.14 176.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 47.3 mm -69.03 -54.0 22.7 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.47 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.29 -178.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -57.15 -41.2 78.69 Favored 'General case' 0 C--N 1.309 -1.167 0 C-N-CA 124.806 1.242 . . . . 0.0 112.802 -172.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -81.87 -21.82 37.25 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.925 -0.71 . . . . 0.0 111.698 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -80.08 -36.45 35.5 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 176.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -61.83 104.44 0.45 Allowed 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 125.707 1.603 . . . . 0.0 109.221 175.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 72.1 mt -83.28 -45.25 18.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.65 -175.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -82.26 -11.01 58.91 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.879 -0.601 . . . . 0.0 112.29 -170.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.18 53.95 3.73 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.718 177.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -115.68 -17.59 11.06 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 121.566 0.698 . . . . 0.0 110.435 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.86 9.85 62.07 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -144.95 125.97 14.53 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.4 HG11 ' HB ' ' A' ' 100' ' ' ILE . 1.0 OUTLIER -90.56 117.9 34.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 123.455 0.472 . . . . 0.0 111.702 -178.362 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -84.79 175.66 9.01 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.5 178.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.534 ' O ' HG13 ' A' ' 142' ' ' VAL . 84.2 t80 -62.3 -43.26 99.24 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.709 -177.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -63.77 -21.99 66.69 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -87.78 -35.62 17.76 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -72.98 -36.66 67.13 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.72 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 138' ' ' TYR . 33.8 m -59.48 -35.44 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-O 120.995 0.426 . . . . 0.0 111.7 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -70.51 -29.62 66.18 Favored 'General case' 0 C--O 1.205 -1.241 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.977 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 73.2 mtp -57.78 -40.38 79.71 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.794 0.438 . . . . 0.0 112.09 -177.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 51.8 tpp . . . . . 0 C--N 1.321 -0.669 0 CA-C-O 121.22 0.533 . . . . 0.0 110.555 -178.831 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 95.3 mttt . . . . . 0 N--CA 1.442 -0.863 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -82.42 -37.22 25.81 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.96 -47.55 85.91 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.728 0.642 . . . . 0.0 109.679 176.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.628 ' O ' HG12 ' B' ' 89' ' ' ILE . 38.8 m95 -63.71 -43.12 97.53 Favored 'General case' 0 C--O 1.199 -1.573 0 CA-C-O 119.415 -0.326 . . . . 0.0 111.486 175.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -53.09 -51.75 60.82 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.87 0.843 . . . . 0.0 109.191 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -58.24 -45.66 87.35 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 113.43 -1.714 . . . . 0.0 109.595 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.25 -49.4 75.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.13 178.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.628 HG12 ' O ' ' B' ' 85' ' ' TRP . 51.8 mm -57.71 -51.44 70.17 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.468 0 C-N-CA 123.347 0.659 . . . . 0.0 109.312 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -61.8 -28.94 69.82 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.239 -177.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . 0.426 ' HD2' HD13 ' A' ' 39' ' ' LEU . 4.5 tppp? -81.71 -53.29 6.34 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 120.983 0.421 . . . . 0.0 110.975 175.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.93 -44.89 68.69 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -174.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp . . . . . 0 C--N 1.317 -0.831 0 CA-C-O 121.801 0.81 . . . . 0.0 110.222 -175.061 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.457 ' HB3' HD12 ' A' ' 9' ' ' ILE . 14.4 tp . . . . . 0 N--CA 1.422 -1.861 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.429 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 10.0 p -68.15 142.87 55.61 Favored 'General case' 0 N--CA 1.424 -1.726 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.632 178.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -59.18 -33.29 70.77 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 123.936 0.894 . . . . 0.0 112.481 -171.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.452 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 34.2 tt0 -66.38 -41.5 89.32 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.23 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.429 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 12.3 mm100 -67.69 -40.66 84.35 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.569 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 63.5 mt -58.12 -41.38 80.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.926 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.49 95.53 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 121.51 0.671 . . . . 0.0 110.921 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 7' ' ' GLU . 30.3 mt-10 -69.89 -30.96 68.52 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.727 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -75.71 -23.77 56.13 Favored 'General case' 0 C--O 1.189 -2.1 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.979 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -63.38 -46.75 85.03 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 120.838 0.351 . . . . 0.0 110.762 176.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -68.34 -40.06 81.71 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.132 -0.627 . . . . 0.0 111.529 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.04 -38.91 89.56 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-O 121.226 0.536 . . . . 0.0 109.803 178.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -60.06 -46.57 89.1 Favored 'General case' 0 C--O 1.2 -1.548 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.982 176.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.1 m -69.36 -17.2 63.66 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.374 -178.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.72 -33.48 64.38 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 176.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.545 ' CD2' HG21 ' A' ' 35' ' ' VAL . 20.4 m-85 -89.86 -38.61 13.62 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.821 178.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -80.79 97.93 7.56 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 176.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -75.1 -6.92 52.08 Favored 'General case' 0 C--N 1.288 -2.076 0 CA-C-N 115.265 -0.879 . . . . 0.0 113.223 -176.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.42 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 18.9 m-20 -102.67 -14.53 16.66 Favored 'General case' 0 C--O 1.244 0.778 0 C-N-CA 119.379 -0.928 . . . . 0.0 109.38 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.78 45.92 94.21 Favored Glycine 0 C--N 1.339 0.722 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -175.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.42 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 2.7 p30 -113.3 -16.24 12.54 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -173.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.23 4.79 50.25 Favored Glycine 0 C--N 1.309 -0.935 0 C-N-CA 121.149 -0.548 . . . . 0.0 113.355 178.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 79.9 p -132.92 139.32 47.29 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 117.458 0.629 . . . . 0.0 109.63 173.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.9 mt -112.04 129.82 66.82 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.8 p -99.28 174.58 6.23 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.908 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.4 p -66.18 -31.25 71.97 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 121.611 0.72 . . . . 0.0 109.866 176.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -61.56 -50.62 71.91 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.439 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.32 -42.91 92.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.817 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.0 mt -56.78 -53.37 58.56 Favored 'General case' 0 C--O 1.22 -0.452 0 O-C-N 123.573 0.546 . . . . 0.0 111.273 177.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.74 -37.43 94.35 Favored Glycine 0 C--O 1.226 -0.364 0 C-N-CA 120.201 -0.999 . . . . 0.0 112.837 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 70.3 m -62.69 -46.19 89.27 Favored 'General case' 0 C--O 1.25 1.114 0 CA-C-N 116.948 0.374 . . . . 0.0 111.339 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.545 HG21 ' CD2' ' A' ' 19' ' ' PHE . 32.9 m -71.17 -34.05 53.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 C-N-CA 120.164 -0.614 . . . . 0.0 110.56 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.637 ' HB3' ' O ' ' A' ' 41' ' ' GLN . 62.1 mtt -66.99 -36.04 81.28 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.418 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -62.34 -41.31 98.47 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.288 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.9 m -67.68 -27.4 66.81 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.998 176.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 97.4 mt -82.47 -10.5 59.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.803 0.335 . . . . 0.0 111.125 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.83 24.65 48.6 Favored Glycine 0 N--CA 1.439 -1.148 0 C-N-CA 121.169 -0.539 . . . . 0.0 112.815 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.637 ' O ' ' HB3' ' A' ' 36' ' ' MET . 48.5 tt0 -155.23 100.26 2.14 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -122.26 92.59 48.89 Favored Pre-proline 0 C--N 1.304 -1.402 0 C-N-CA 119.265 -0.974 . . . . 0.0 113.443 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.552 ' HD2' ' SD ' ' A' ' 36' ' ' MET . 50.2 Cg_exo -56.8 161.62 9.97 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 123.404 2.736 . . . . 0.0 111.695 171.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.47 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 19.1 p -74.6 160.25 31.1 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -176.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -51.9 -44.45 63.8 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 124.175 0.99 . . . . 0.0 112.613 -177.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.69 76.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.062 0.458 . . . . 0.0 110.962 -178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 51' ' ' MET . 39.9 mm-40 -72.78 -42.75 63.61 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.45 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 44' ' ' THR . 79.2 mt -62.63 -39.53 94.14 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.549 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.9 tp60 -67.22 -35.15 78.99 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.732 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.19 -39.17 78.84 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 123.285 0.366 . . . . 0.0 110.128 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.462 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 61.5 mtt -57.09 -47.31 81.34 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.027 174.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.9 mt -59.45 -50.35 80.24 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.247 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -63.04 -15.69 57.34 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -173.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -71.16 -39.24 72.05 Favored 'General case' 0 N--CA 1.384 -3.732 0 O-C-N 121.759 -0.588 . . . . 0.0 110.275 175.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.0 m -99.57 -20.69 5.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.307 -177.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -68.04 99.3 0.85 Allowed 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.258 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.45 -29.68 22.63 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.799 -173.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -91.03 -9.79 44.56 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.967 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.94 46.77 70.49 Favored Glycine 0 N--CA 1.441 -0.987 0 CA-C-N 115.399 -0.819 . . . . 0.0 113.255 174.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -101.91 -9.43 20.7 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.308 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.84 -6.3 43.89 Favored Glycine 0 N--CA 1.44 -1.053 0 C-N-CA 120.537 -0.839 . . . . 0.0 113.596 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.8 p -130.01 161.71 30.34 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-N 117.489 0.645 . . . . 0.0 110.991 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.531 ' O ' ' HA ' ' A' ' 26' ' ' THR . 29.1 mt -99.05 119.37 46.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.558 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 7.4 t0 -89.27 161.72 16.24 Favored 'General case' 0 C--N 1.292 -1.922 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.53 -53.58 55.28 Favored Pre-proline 0 CA--C 1.569 1.702 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -176.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.558 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 8.7 Cg_endo -50.76 -38.45 56.65 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 123.224 2.616 . . . . 0.0 113.603 174.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -69.62 -37.43 76.83 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.796 0.808 . . . . 0.0 109.688 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -67.63 -39.07 84.66 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.327 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 78.2 mt -62.68 -39.72 94.87 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.492 177.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.7 m -56.07 -48.34 76.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.301 0.572 . . . . 0.0 109.634 176.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 28.3 ttp -60.67 -42.47 97.15 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.596 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 20.9 mmt -73.98 -36.18 64.53 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.26 -41.05 97.12 Favored 'General case' 0 C--O 1.21 -1.005 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 175.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -63.06 -30.03 71.28 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.346 175.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -63.78 -41.03 98.03 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 121.151 0.5 . . . . 0.0 109.934 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.5 mtm . . . . . 0 C--N 1.31 -1.126 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.564 -177.208 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 . . . . . 0 C--O 1.215 -0.74 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 2.2 mp0 -46.87 -57.31 5.06 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 125.757 1.623 . . . . 0.0 110.348 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.59 -45.87 70.86 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.421 -175.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.8 mm -73.67 -35.7 44.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 120.704 0.287 . . . . 0.0 111.393 -174.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -74.68 -32.42 62.2 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -62.04 -45.45 93.51 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 176.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.415 ' O ' HG11 ' A' ' 91' ' ' VAL . . . -67.02 -38.66 86.34 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 113.964 -1.471 . . . . 0.0 111.261 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -66.4 -41.67 88.98 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -53.87 -40.46 66.56 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 111.284 177.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.415 HG11 ' O ' ' A' ' 88' ' ' ALA . 11.6 p -75.58 -29.2 20.5 Favored 'Isoleucine or valine' 0 C--O 1.246 0.911 0 CA-C-O 120.917 0.389 . . . . 0.0 111.188 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -77.32 -62.71 1.57 Allowed 'General case' 0 C--O 1.21 -1.008 0 C-N-CA 119.689 -0.805 . . . . 0.0 111.084 178.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -85.84 94.75 9.23 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.764 0.792 . . . . 0.0 111.704 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -80.44 -17.47 51.64 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 114.912 -1.04 . . . . 0.0 113.367 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -92.65 -12.23 32.12 Favored 'General case' 0 CA--C 1.499 -0.994 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -176.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.95 44.54 30.08 Favored Glycine 0 N--CA 1.444 -0.785 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -93.43 -18.48 22.29 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.0 17.32 74.91 Favored Glycine 0 C--O 1.241 0.537 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.458 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 79.3 m-85 -150.0 152.61 35.18 Favored 'General case' 0 N--CA 1.437 -1.1 0 C-N-CA 124.617 1.167 . . . . 0.0 108.437 -177.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.3 mt -109.61 131.67 59.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.303 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 174.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.5 p -110.32 156.33 20.88 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.19 -41.58 97.07 Favored 'General case' 0 C--O 1.212 -0.882 0 C-N-CA 122.685 0.394 . . . . 0.0 111.504 -178.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.62 -49.14 78.9 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 123.16 0.287 . . . . 0.0 111.035 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -56.44 -52.41 64.78 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.899 0.857 . . . . 0.0 109.7 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.498 ' O ' HG11 ' A' ' 108' ' ' VAL . 8.0 tt -63.54 -40.52 97.21 Favored 'General case' 0 N--CA 1.413 -2.306 0 CA-C-N 113.941 -1.482 . . . . 0.0 110.192 -172.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.427 ' HD2' ' C ' ' A' ' 106' ' ' ARG . 4.9 tmm_? -61.11 -43.1 99.4 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -68.98 -37.52 78.8 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.002 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.582 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.1 p -66.32 -29.89 48.09 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.265 0 C-N-CA 119.497 -0.881 . . . . 0.0 109.623 177.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.4 mmt -60.52 -40.11 90.26 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-O 120.646 0.26 . . . . 0.0 110.593 176.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.3 m -60.83 -40.23 92.0 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.936 175.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -75.4 -17.27 60.24 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.808 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 68.4 mt -98.93 -20.61 16.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.994 0.426 . . . . 0.0 110.857 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.41 11.62 47.56 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.642 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -89.18 137.11 32.62 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -177.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -118.21 90.98 3.45 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-O 121.495 0.664 . . . . 0.0 110.258 177.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 75.9 mt -110.95 167.0 10.58 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 28.7 p -100.7 172.54 7.02 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.8 -24.94 67.96 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -67.87 -40.1 83.63 Favored 'General case' 0 N--CA 1.428 -1.547 0 C-N-CA 123.046 0.538 . . . . 0.0 110.784 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -75.49 -42.94 51.6 Favored 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 121.811 -0.556 . . . . 0.0 111.996 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.425 ' O ' HG12 ' A' ' 125' ' ' ILE . 14.1 m -68.39 -29.58 44.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 C-N-CA 120.285 -0.566 . . . . 0.0 109.913 -178.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -70.67 -43.67 68.64 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.324 176.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -64.2 -35.11 79.72 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.411 ' SD ' HD23 ' A' ' 105' ' ' LEU . 62.8 mtt -54.15 -51.26 64.85 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.151 175.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.5 mm -69.11 -59.72 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.226 -177.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -61.82 -33.53 74.3 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 -170.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -81.08 -24.39 37.81 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 119.985 -0.686 . . . . 0.0 110.673 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.683 ' HA ' ' SD ' ' A' ' 144' ' ' MET . . . -91.93 -12.85 32.31 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 122.375 1.083 . . . . 0.0 109.768 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -78.82 72.77 5.36 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 122.819 1.295 . . . . 0.0 110.286 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . 0.412 ' HB ' ' OE1' ' A' ' 140' ' ' GLU . 35.7 mt -82.79 -12.26 12.13 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 CA-C-N 114.291 -1.322 . . . . 0.0 107.938 174.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -79.92 -10.42 59.77 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.81 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.64 40.62 99.39 Favored Glycine 0 N--CA 1.442 -0.964 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.744 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -112.34 -16.42 12.95 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.319 0.581 . . . . 0.0 110.142 -177.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 90.99 14.32 57.91 Favored Glycine 0 C--O 1.25 1.147 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 -177.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.458 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 26.0 mt-30 -150.11 139.49 21.4 Favored 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 124.699 1.2 . . . . 0.0 107.791 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 1.2 p -76.23 123.99 33.54 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.139 0.495 . . . . 0.0 110.977 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -91.71 154.08 19.22 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.537 ' O ' HG11 ' A' ' 142' ' ' VAL . 82.8 t80 -57.95 -48.99 78.32 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 124.328 1.051 . . . . 0.0 110.151 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -66.71 -22.14 66.07 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.412 ' OE1' ' HB ' ' A' ' 130' ' ' ILE . 29.0 mm-40 -87.32 -37.52 17.06 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -69.21 -35.03 75.78 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.295 -178.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.537 HG11 ' O ' ' A' ' 138' ' ' TYR . 22.2 m -65.19 -31.31 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 121.173 0.511 . . . . 0.0 110.066 177.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -70.83 -48.55 53.43 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.683 ' SD ' ' HA ' ' A' ' 128' ' ' ALA . 82.7 mtp -66.59 -15.82 63.72 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.328 -178.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 57.3 tpp . . . . . 0 C--N 1.312 -1.022 0 CA-C-O 120.818 0.342 . . . . 0.0 110.199 177.397 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . 0.562 ' O ' ' HB2' ' B' ' 86' ' ' LYS . 64.1 tttp . . . . . 0 N--CA 1.452 -0.37 0 CA-C-O 120.62 0.248 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -76.82 -27.64 55.24 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-O 121.104 0.478 . . . . 0.0 110.595 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.61 -61.35 2.49 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.582 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.533 ' O ' HG12 ' B' ' 89' ' ' ILE . 57.2 m95 -64.62 -31.05 72.1 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . 0.562 ' HB2' ' O ' ' B' ' 82' ' ' LYS . 78.8 tttt -52.98 -50.02 64.99 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 124.454 1.102 . . . . 0.0 109.866 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -76.38 -41.17 48.92 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.461 177.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.13 -59.8 4.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -177.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.533 HG12 ' O ' ' B' ' 85' ' ' TRP . 32.1 pt -68.56 -27.94 38.33 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.707 0 C-N-CA 120.389 -0.524 . . . . 0.0 111.216 -178.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . 0.402 ' HB2' ' O ' ' B' ' 86' ' ' LYS . 8.8 tt0 -62.81 -61.76 2.19 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -65.31 -35.19 80.24 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.285 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.02 -33.24 65.62 Favored 'General case' 0 C--O 1.247 0.926 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.519 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 25.0 tptp . . . . . 0 CA--C 1.51 -0.562 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.419 ' HB3' HD13 ' A' ' 9' ' ' ILE . 10.2 tp . . . . . 0 N--CA 1.43 -1.425 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 21.2 p -80.81 155.95 26.38 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.816 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -57.45 -44.23 84.61 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -173.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -69.18 -34.05 74.33 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.57 -177.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -63.55 -44.14 95.01 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.488 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 29.6 mt -61.61 -33.25 56.46 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.103 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.541 179.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.13 -46.17 85.3 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-O 121.019 0.437 . . . . 0.0 110.454 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.32 -48.94 75.69 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.406 -0.815 . . . . 0.0 108.986 175.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.413 ' CD2' HD23 ' A' ' 4' ' ' LEU . 56.6 m-85 -71.41 -16.6 62.4 Favored 'General case' 0 C--O 1.187 -2.187 0 CA-C-N 115.324 -0.853 . . . . 0.0 113.148 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 96.0 mttt -69.12 -43.83 73.63 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-O 121.539 0.685 . . . . 0.0 109.279 173.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -71.49 -41.13 69.69 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.644 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.43 -27.96 65.72 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.332 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 26.2 t80 -64.88 -52.74 54.89 Favored 'General case' 0 C--O 1.198 -1.623 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -71.84 -16.76 62.17 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 123.389 0.431 . . . . 0.0 110.836 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.4 tp -65.72 -36.55 83.93 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 174.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.403 ' CE2' HG23 ' A' ' 35' ' ' VAL . 6.5 m-85 -89.4 -41.86 11.86 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.619 175.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -80.65 81.94 6.78 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-O 122.582 1.182 . . . . 0.0 109.588 176.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -75.96 -19.61 58.6 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 114.287 -1.324 . . . . 0.0 112.861 -173.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.589 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 24.7 m-20 -78.15 -14.46 59.46 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.218 178.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.18 33.37 85.01 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.589 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 6.3 p-10 -112.97 -16.24 12.71 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.939 0.399 . . . . 0.0 110.793 -176.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.28 26.33 14.25 Favored Glycine 0 N--CA 1.441 -1.002 0 N-CA-C 115.635 1.014 . . . . 0.0 115.635 176.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.3 p -141.68 130.53 23.0 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 118.233 1.017 . . . . 0.0 109.096 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 61.2 mt -91.97 115.97 32.12 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.172 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.2 p -96.21 166.78 11.57 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 123.807 0.692 . . . . 0.0 109.944 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 36.4 p -64.27 -27.34 68.97 Favored 'General case' 0 C--O 1.249 1.075 0 CA-C-O 121.216 0.532 . . . . 0.0 110.087 177.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -54.59 -56.85 14.71 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 114.971 -1.013 . . . . 0.0 108.911 174.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.67 -40.13 92.08 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.167 -1.379 . . . . 0.0 111.122 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.53 -60.26 3.8 Favored 'General case' 0 C--O 1.212 -0.898 0 O-C-N 123.58 0.55 . . . . 0.0 110.49 175.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.6 -30.39 72.0 Favored Glycine 0 C--O 1.216 -1.02 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.773 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.6 m -68.98 -49.72 55.38 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.716 0.258 . . . . 0.0 110.915 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.565 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 27.1 m -66.91 -39.18 82.93 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.1 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -58.52 -45.48 88.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.532 0.52 . . . . 0.0 110.261 175.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -62.83 -35.41 79.84 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 123.255 0.622 . . . . 0.0 109.951 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 m -76.34 -12.93 60.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.814 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 97.4 mt -96.9 -17.68 19.99 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.169 177.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.8 32.11 9.47 Favored Glycine 0 C--N 1.311 -0.818 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.402 ' C ' HD21 ' A' ' 42' ' ' ASN . 63.7 tt0 -129.49 133.34 47.23 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.402 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -129.94 81.64 68.49 Favored Pre-proline 0 C--N 1.305 -1.363 0 O-C-N 121.034 -1.041 . . . . 0.0 113.596 -178.07 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -78.68 155.56 27.47 Favored 'Trans proline' 0 C--O 1.247 0.951 0 C-N-CA 122.13 1.887 . . . . 0.0 109.994 171.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.453 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 70.4 p -84.1 167.21 17.0 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.793 0.33 . . . . 0.0 111.757 -177.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -55.78 -45.73 78.09 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.506 1.122 . . . . 0.0 112.077 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.79 -41.98 92.38 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 120.766 0.317 . . . . 0.0 110.942 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -63.92 -48.33 77.02 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.476 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 44' ' ' THR . 91.1 mt -59.0 -42.65 90.59 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.231 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -69.78 -41.84 74.59 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -66.33 -35.92 81.6 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.436 0.636 . . . . 0.0 109.765 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' A' ' 48' ' ' LEU . 38.7 ttm -57.35 -39.97 77.05 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.593 1.557 . . . . 0.0 110.159 177.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 59.3 mt -74.27 -49.6 31.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.499 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.17 -31.0 62.99 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.383 -0.826 . . . . 0.0 113.02 -172.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -70.64 -11.36 60.89 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.549 HG13 ' SD ' ' A' ' 71' ' ' MET . 28.4 m -119.89 -18.19 6.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 O-C-N 122.403 -0.186 . . . . 0.0 110.863 174.085 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -70.13 107.72 3.8 Favored 'General case' 0 N--CA 1.444 -0.772 0 O-C-N 123.777 0.673 . . . . 0.0 111.076 -176.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.86 -9.86 54.77 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.602 -176.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.58 -11.63 20.82 Favored 'General case' 0 CA--C 1.493 -1.244 0 C-N-CA 119.964 -0.694 . . . . 0.0 110.503 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.63 41.95 99.07 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 -174.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.9 p-10 -114.3 -11.23 12.6 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.187 0.518 . . . . 0.0 110.867 -176.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.29 15.6 55.22 Favored Glycine 0 N--CA 1.431 -1.635 0 C-N-CA 120.82 -0.705 . . . . 0.0 114.418 173.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 11.9 p -137.52 147.11 44.93 Favored 'General case' 0 C--O 1.248 1.022 0 CA-C-N 117.812 0.806 . . . . 0.0 111.628 177.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.6 mt -99.68 110.53 27.05 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -84.58 -179.55 7.17 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.437 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 44.7 t80 -58.76 -53.93 61.36 Favored Pre-proline 0 C--N 1.311 -1.098 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -175.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.437 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.2 Cg_endo -52.98 -41.91 68.1 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.901 2.401 . . . . 0.0 111.757 176.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -67.25 -44.74 78.67 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.022 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.579 ' O ' ' HG2' ' A' ' 72' ' ' MET . 86.6 t80 -60.12 -41.82 93.45 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.049 0.539 . . . . 0.0 109.846 177.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.9 mt -65.09 -55.55 18.11 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.353 177.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 94.8 m -55.94 -41.43 74.63 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.417 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.549 ' SD ' HG13 ' A' ' 55' ' ' VAL . 20.0 ttp -55.65 -47.03 77.33 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.629 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.579 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 10.5 mmt -71.73 -41.31 68.66 Favored 'General case' 0 CA--C 1.486 -1.494 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.769 -176.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.5 -27.89 69.28 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.542 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -83.55 -30.59 26.94 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.453 0.644 . . . . 0.0 110.776 175.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -85.31 -3.29 58.78 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.895 0.855 . . . . 0.0 110.272 -173.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.517 ' HG3' ' O ' ' A' ' 72' ' ' MET . 61.7 mtt . . . . . 0 N--CA 1.429 -1.475 0 CA-C-O 121.947 0.88 . . . . 0.0 110.053 175.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 . . . . . 0 N--CA 1.442 -0.862 0 CA-C-O 121.069 0.462 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -63.84 -33.52 75.88 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.938 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 34.3 tt0 -65.3 -31.1 72.07 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 122.106 0.955 . . . . 0.0 109.494 178.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.7 mm -81.42 -29.09 10.57 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 -175.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -78.73 -26.25 44.68 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.617 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.444 ' HB3' ' O ' ' A' ' 84' ' ' GLU . 41.2 tt0 -62.67 -54.87 32.88 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 172.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.45 -39.74 76.95 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 113.741 -1.572 . . . . 0.0 110.617 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -62.49 -46.32 88.97 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.49 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 78.5 mtm180 -68.02 -25.09 65.21 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 14.0 p -82.79 -19.72 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 120.196 -0.601 . . . . 0.0 110.633 178.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -91.84 -56.84 2.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -84.98 83.99 7.87 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 122.09 0.948 . . . . 0.0 109.155 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -78.84 -35.17 44.37 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.642 -177.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -72.16 -14.32 61.79 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.516 0.674 . . . . 0.0 110.581 -178.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.62 54.09 10.95 Favored Glycine 0 N--CA 1.431 -1.685 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.288 175.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -89.21 -18.56 26.85 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 121.02 0.438 . . . . 0.0 110.13 176.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.18 13.0 75.17 Favored Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -178.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -149.7 143.21 25.32 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.436 ' HB ' HG11 ' A' ' 136' ' ' VAL . 2.8 mt -87.84 109.68 19.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.8 m -80.18 140.04 36.51 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.47 -39.45 83.75 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 122.48 0.312 . . . . 0.0 111.416 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.81 -50.18 74.49 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.303 0.377 . . . . 0.0 111.497 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -70.51 -38.21 74.25 Favored 'General case' 0 CA--C 1.506 -0.749 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.787 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.47 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.5 tm? -59.58 -43.89 93.5 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.418 ' HA ' HG13 ' A' ' 121' ' ' VAL . 39.2 ttt180 -61.62 -45.13 95.4 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.536 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.5 m170 -59.87 -49.4 77.85 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.671 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.57 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -64.88 -33.36 63.03 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.385 0 C-N-CA 120.134 -0.626 . . . . 0.0 110.573 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.47 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.1 mmt -61.23 -41.94 97.75 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 120.887 0.375 . . . . 0.0 111.534 179.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 61.3 m -61.0 -38.51 86.29 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.217 176.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -76.73 -22.59 53.64 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.073 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 95.1 mt -88.95 -19.71 25.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.201 0.524 . . . . 0.0 110.541 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.36 0.55 55.71 Favored Glycine 0 N--CA 1.436 -1.336 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.162 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -70.62 -38.15 73.9 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.8 mttm 59.24 33.27 22.55 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.32 174.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 60.2 mt -64.52 138.25 58.3 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.621 -177.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 36.8 p -76.91 174.42 10.6 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.857 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -63.35 -44.32 95.15 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 116.9 -0.136 . . . . 0.0 111.263 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.415 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 1.4 mp0 -59.52 -37.6 78.76 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.78 -55.77 13.45 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.464 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.477 ' O ' HG12 ' A' ' 125' ' ' ILE . 11.4 m -64.21 -32.55 57.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.032 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -60.88 -45.74 93.39 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.688 0.795 . . . . 0.0 110.295 175.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -65.18 -43.32 92.06 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.184 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 54.1 mtt -56.54 -37.27 70.27 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.301 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.477 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.9 mm -76.22 -58.27 4.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -50.97 -44.83 60.76 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.935 1.294 . . . . 0.0 113.957 -173.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -83.54 -13.61 54.11 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 119.65 -0.82 . . . . 0.0 111.081 -174.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -96.76 -22.3 17.04 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.505 0.669 . . . . 0.0 109.582 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -72.7 92.53 1.56 Allowed 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.546 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.0 mt -82.41 -19.59 10.4 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.668 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.841 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -89.22 -12.06 41.88 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-O 121.408 0.623 . . . . 0.0 110.866 -173.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.09 36.7 60.36 Favored Glycine 0 N--CA 1.429 -1.771 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.2 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -95.3 -16.6 22.3 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.393 0.616 . . . . 0.0 109.438 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.29 13.19 82.22 Favored Glycine 0 CA--C 1.503 -0.705 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -175.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -151.09 144.73 25.01 Favored 'General case' 0 N--CA 1.418 -2.061 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 -176.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.436 HG11 ' HB ' ' A' ' 100' ' ' ILE . 2.4 p -97.27 112.21 28.8 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.99 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -172.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.447 ' HB3' ' OE2' ' A' ' 140' ' ' GLU . 45.1 t30 -76.38 162.62 27.72 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.825 178.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -56.21 -48.3 76.69 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 123.431 0.693 . . . . 0.0 112.374 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.435 ' HA ' HG23 ' A' ' 142' ' ' VAL . 41.3 mt-10 -66.65 -41.13 88.74 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.262 0.553 . . . . 0.0 111.422 -178.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.447 ' OE2' ' HB3' ' A' ' 137' ' ' ASN . 2.8 mp0 -56.78 -45.71 81.98 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.767 174.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -64.73 -50.84 65.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.843 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.435 HG23 ' HA ' ' A' ' 139' ' ' GLU . 24.2 m -62.43 -37.97 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -176.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -51.68 -59.51 4.21 Favored 'General case' 0 C--O 1.233 0.237 0 O-C-N 123.986 0.804 . . . . 0.0 110.482 -177.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.72 -26.68 44.81 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -172.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 2.6 tmm? . . . . . 0 C--N 1.318 -0.802 0 C-N-CA 120.275 -0.57 . . . . 0.0 110.959 -174.101 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt . . . . . 0 C--O 1.211 -0.944 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -69.55 -31.59 69.88 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.432 0.634 . . . . 0.0 109.334 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.453 ' HA ' ' CE1' ' B' ' 87' ' ' HIS . . . -61.98 -54.92 35.04 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.14 173.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 26.9 m95 -57.68 -40.96 80.61 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.341 175.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -54.72 -58.26 8.26 Favored 'General case' 0 CA--C 1.501 -0.934 0 C-N-CA 123.45 0.7 . . . . 0.0 110.169 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . 0.453 ' CE1' ' HA ' ' B' ' 84' ' ' ALA . 2.8 p-80 -65.49 -30.85 71.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.243 -0.583 . . . . 0.0 112.465 -179.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.08 -47.67 73.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.301 0.572 . . . . 0.0 110.061 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 85.4 mt -66.47 -36.66 77.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.73 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -59.01 -45.36 90.88 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -64.55 -43.87 92.59 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.271 175.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.18 -33.72 73.9 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.318 0.58 . . . . 0.0 110.983 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 22.6 mtpp . . . . . 0 C--N 1.316 -0.873 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.857 176.508 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.458 ' HB3' HD13 ' A' ' 9' ' ' ILE . 12.0 tp . . . . . 0 N--CA 1.425 -1.695 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.9 p -82.59 152.94 25.72 Favored 'General case' 0 N--CA 1.428 -1.564 0 O-C-N 123.364 0.415 . . . . 0.0 110.9 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -53.53 -45.19 69.68 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -171.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.55 -37.91 88.09 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-O 120.733 0.301 . . . . 0.0 110.992 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.401 ' HB3' ' HE3' ' A' ' 76' ' ' MET . 5.8 mm-40 -72.76 -33.09 66.11 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.499 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 36.3 mt -66.08 -34.45 70.34 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.095 176.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.5 -37.78 80.39 Favored 'General case' 0 C--O 1.252 1.21 0 CA-C-O 121.815 0.817 . . . . 0.0 109.88 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -62.75 -40.08 96.13 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.155 176.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -79.75 -16.36 55.74 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 30.5 mmtp -61.92 -47.2 85.98 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 171.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -59.78 -52.95 63.26 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 114.285 -1.325 . . . . 0.0 110.327 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.94 82.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.76 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -65.78 -45.91 80.71 Favored 'General case' 0 C--O 1.206 -1.232 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.601 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 32.1 t -69.25 -23.74 63.9 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 120.732 0.301 . . . . 0.0 111.047 -177.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.292 1.0 OUTLIER -62.1 -57.03 13.09 Favored 'General case' 0 CA--C 1.476 -1.866 0 CA-C-O 123.196 1.474 . . . . 0.0 107.091 174.268 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.463 ' CZ ' HD21 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -74.43 -33.89 63.07 Favored 'General case' 1 N--CA 1.368 -4.564 0 CA-C-N 111.666 -2.515 . . . . 0.0 109.605 -167.72 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -78.19 84.38 4.41 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-O 122.235 1.017 . . . . 0.0 108.416 173.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.7 mmtm -67.75 -32.23 72.68 Favored 'General case' 0 N--CA 1.421 -1.908 0 CA-C-N 113.931 -1.486 . . . . 0.0 112.439 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -87.34 -13.48 43.44 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.919 -176.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.96 50.57 64.33 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 -177.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -113.4 -12.11 13.03 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -176.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.88 5.8 57.34 Favored Glycine 0 C--N 1.306 -1.128 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.309 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.8 p -143.04 145.62 33.07 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 117.758 0.779 . . . . 0.0 111.838 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.8 mt -95.46 118.02 40.74 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 69.6 p -100.79 169.5 8.96 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.139 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 77.8 p -63.31 -30.95 71.99 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 121.255 0.55 . . . . 0.0 109.995 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.1 tttm -50.04 -55.97 12.66 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.759 1.223 . . . . 0.0 109.348 175.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -67.65 -40.07 84.57 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.626 -176.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.463 HD21 ' CZ ' ' A' ' 19' ' ' PHE . 83.9 mt -54.17 -55.85 23.88 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.978 0.894 . . . . 0.0 109.498 177.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.76 -21.38 73.01 Favored Glycine 0 C--O 1.215 -1.093 0 CA-C-N 115.4 -0.818 . . . . 0.0 113.288 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.7 m -74.32 -48.27 29.32 Favored 'General case' 0 C--O 1.254 1.293 0 CA-C-N 117.497 0.648 . . . . 0.0 110.376 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 m -68.64 -32.81 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.451 ' HB3' ' HB3' ' A' ' 41' ' ' GLN . 41.1 mtm -73.26 -27.71 61.73 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -61.24 -39.69 91.25 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.0 m -63.46 -27.55 69.36 Favored 'General case' 0 CA--C 1.554 1.129 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.457 176.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -88.88 -23.64 22.71 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.194 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 103.74 11.99 31.4 Favored Glycine 0 C--N 1.308 -1.026 0 C-N-CA 120.189 -1.005 . . . . 0.0 112.39 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.451 ' HB3' ' HB3' ' A' ' 36' ' ' MET . 2.4 tp-100 -101.28 125.01 47.86 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 179.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -125.87 75.26 71.2 Favored Pre-proline 0 C--N 1.294 -1.825 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.424 ' HG2' HD22 ' A' ' 48' ' ' LEU . 5.6 Cg_exo -77.64 147.91 25.39 Favored 'Trans proline' 0 N--CA 1.448 -1.164 0 C-N-CA 121.777 1.651 . . . . 0.0 109.977 176.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.5 p -68.56 154.02 42.66 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-O 120.533 0.206 . . . . 0.0 110.845 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -59.48 -30.57 68.63 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 122.801 0.44 . . . . 0.0 110.982 -177.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.27 78.54 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.338 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.428 ' O ' ' HG3' ' A' ' 51' ' ' MET . 55.2 mm-40 -65.97 -43.34 88.14 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.98 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.424 HD22 ' HG2' ' A' ' 43' ' ' PRO . 85.6 mt -67.43 -34.15 76.62 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.327 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.41 -44.77 90.19 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 178.181 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.56 -41.22 98.42 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.35 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.428 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 67.5 mtt -61.84 -42.53 99.14 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.084 178.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.9 mt -63.36 -45.07 99.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.998 0.428 . . . . 0.0 110.584 176.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -58.59 -18.28 28.8 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -175.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -64.82 -41.49 95.72 Favored 'General case' 0 N--CA 1.39 -3.472 0 O-C-N 121.783 -0.573 . . . . 0.0 110.051 177.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.584 HG13 ' SD ' ' A' ' 71' ' ' MET . 17.1 m -104.74 -17.33 7.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.429 -178.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -67.89 113.43 5.61 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -178.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.7 -23.73 36.61 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.229 0.537 . . . . 0.0 110.612 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -99.01 -11.89 21.1 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.399 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.52 51.55 57.12 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.642 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -115.22 -4.19 12.46 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 120.84 0.353 . . . . 0.0 111.906 -176.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.56 13.66 37.4 Favored Glycine 0 N--CA 1.438 -1.22 0 C-N-CA 120.829 -0.701 . . . . 0.0 113.299 174.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 11.2 p -141.48 139.55 33.35 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.882 0.341 . . . . 0.0 110.564 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 mt -91.47 113.25 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.941 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -83.85 166.19 18.13 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.455 ' CE2' HD13 ' A' ' 69' ' ' LEU . 56.5 t80 -56.79 -57.69 22.36 Favored Pre-proline 0 CA--C 1.555 1.145 0 O-C-N 123.568 0.543 . . . . 0.0 112.213 -177.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.17 -39.51 90.62 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.496 2.131 . . . . 0.0 112.539 177.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -63.4 -44.97 93.15 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.332 0.586 . . . . 0.0 110.287 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.63 -26.32 57.66 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.665 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.455 HD13 ' CE2' ' A' ' 65' ' ' PHE . 80.4 mt -63.98 -42.1 97.33 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 174.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.412 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 47.2 m -56.4 -48.69 76.4 Favored 'General case' 0 C--O 1.239 0.544 0 O-C-N 123.835 0.709 . . . . 0.0 109.152 175.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.584 ' SD ' HG13 ' A' ' 55' ' ' VAL . 40.4 ttp -54.65 -55.4 30.0 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.841 177.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 20.7 mmt -62.33 -38.62 90.16 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.4 -19.31 63.81 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 70' ' ' THR . 95.0 mtt180 -84.11 -29.86 26.42 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.23 0.538 . . . . 0.0 110.507 173.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -83.68 -33.74 25.12 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.803 0.811 . . . . 0.0 109.996 -176.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.401 ' HE3' ' HB3' ' A' ' 8' ' ' GLN . 34.9 ttm . . . . . 0 C--N 1.303 -1.454 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.842 -176.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 121.838 0.828 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -60.34 -45.43 93.48 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.312 -1.313 . . . . 0.0 112.331 -175.715 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -59.52 -42.69 92.84 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 121.776 0.798 . . . . 0.0 110.356 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.0 mm -70.6 -42.87 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 CA-C-N 114.113 -1.403 . . . . 0.0 108.929 -173.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -71.16 -38.08 72.2 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.682 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 52.5 mt-10 -58.62 -46.82 86.24 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 175.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.76 -40.1 91.71 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.094 -179.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -65.44 -49.33 69.54 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.16 0.505 . . . . 0.0 109.966 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 24.5 ttp85 -58.35 -38.79 77.9 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.375 1.07 . . . . 0.0 112.432 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 9.6 p -75.97 -19.57 15.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.643 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -86.69 -50.81 6.52 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.453 174.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -95.59 76.46 3.28 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.947 0.879 . . . . 0.0 110.994 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -79.06 -29.4 43.44 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.542 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.99 -12.98 61.49 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.241 0.543 . . . . 0.0 111.457 -178.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.56 48.47 10.5 Favored Glycine 0 N--CA 1.435 -1.407 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.743 176.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -80.92 -19.91 43.24 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.23 -0.38 85.66 Favored Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 110.759 -0.937 . . . . 0.0 110.759 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.1 p90 -156.74 158.24 36.54 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -178.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.467 ' HB ' HG11 ' A' ' 136' ' ' VAL . 1.7 mt -87.41 106.09 15.84 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.3 t -93.82 143.71 26.09 Favored 'General case' 0 N--CA 1.422 -1.825 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.499 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.56 -38.99 92.93 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 123.218 0.607 . . . . 0.0 111.45 -177.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.7 -46.21 89.76 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.394 0.616 . . . . 0.0 109.981 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.569 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 2.8 tp10 -66.71 -45.64 78.08 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.392 176.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.99 -35.99 78.28 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -175.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.425 ' HB2' HG23 ' A' ' 121' ' ' VAL . 29.5 ttp180 -64.96 -36.2 83.63 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.296 177.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . 0.569 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 42.9 m170 -56.72 -50.97 70.6 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.124 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.686 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.1 p -70.72 -33.06 51.31 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.838 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.36 -177.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 20.9 mmt -62.3 -46.72 87.48 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.3 m -65.23 -30.88 71.81 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.374 0.607 . . . . 0.0 109.498 177.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -71.89 -32.32 67.31 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.462 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.686 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 71.9 mt -85.47 -19.38 31.33 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 121.024 0.44 . . . . 0.0 110.69 -176.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.54 14.15 57.35 Favored Glycine 0 N--CA 1.434 -1.435 0 C-N-CA 120.56 -0.828 . . . . 0.0 111.606 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.42 ' OE1' ' HG3' ' B' ' 91' ' ' LYS . 30.9 mm-40 -74.48 -36.85 63.3 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 55.94 62.23 2.47 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 122.421 1.105 . . . . 0.0 110.78 178.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 71.2 mt -92.81 147.13 23.11 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.2 p -77.84 174.43 11.03 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 120.354 -0.538 . . . . 0.0 110.462 -179.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -68.37 -38.05 81.01 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.149 0.499 . . . . 0.0 109.705 -178.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 1.4 mp0 -63.45 -42.49 98.64 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 177.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -61.99 -54.85 35.96 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.437 1.095 . . . . 0.0 110.53 -177.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.425 HG23 ' HB2' ' A' ' 106' ' ' ARG . 25.3 m -63.39 -36.98 78.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.002 -177.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -72.18 -32.35 66.75 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.699 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -64.2 -47.58 79.21 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 mtt -51.68 -50.47 60.36 Favored 'General case' 0 CA--C 1.503 -0.844 0 O-C-N 123.601 0.563 . . . . 0.0 110.381 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.538 ' CG2' ' HA ' ' A' ' 135' ' ' GLN . 40.4 mm -60.11 -49.46 83.99 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.538 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.143 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.4 ttm180 -65.64 -30.82 71.58 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 123.298 0.639 . . . . 0.0 111.474 -175.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -78.03 -34.03 50.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.842 0.353 . . . . 0.0 110.683 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.13 -28.12 42.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.648 0.737 . . . . 0.0 109.282 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -74.84 94.4 2.77 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.681 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 9.6 mt -82.19 -19.06 10.81 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.804 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.151 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -82.62 -11.5 58.34 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.591 -173.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.3 24.06 72.06 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.177 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -87.11 -17.08 33.65 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.44 0.638 . . . . 0.0 109.768 -177.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 97.01 -18.62 57.2 Favored Glycine 0 N--CA 1.437 -1.277 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.192 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.538 ' HA ' ' CG2' ' A' ' 125' ' ' ILE . 31.8 mt-30 -134.44 147.33 50.41 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.467 HG11 ' HB ' ' A' ' 100' ' ' ILE . 1.7 p -94.76 124.03 47.1 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -173.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -93.4 175.4 6.77 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.548 ' O ' HG13 ' A' ' 142' ' ' VAL . 73.5 t80 -60.19 -45.69 92.26 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -175.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.628 ' O ' HG23 ' A' ' 142' ' ' VAL . 35.6 mm-40 -61.59 -43.58 98.6 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.331 0.586 . . . . 0.0 111.644 -179.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.14 -33.79 75.14 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.041 178.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -67.72 -38.97 84.3 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.998 176.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.628 HG23 ' O ' ' A' ' 139' ' ' GLU . 7.2 m -59.05 -38.53 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.46 -178.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -76.37 -41.46 48.01 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.617 -175.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 3.7 ppp? -76.52 -32.2 58.13 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.155 -0.618 . . . . 0.0 112.101 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.5 tpt . . . . . 0 C--N 1.322 -0.59 0 CA-C-O 121.114 0.483 . . . . 0.0 110.571 179.606 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp . . . . . 0 N--CA 1.418 -2.04 0 CA-C-O 120.404 0.145 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -58.92 -55.49 34.42 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.481 1.134 . . . . 0.0 108.675 176.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.03 -50.99 60.33 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 112.613 -2.085 . . . . 0.0 112.263 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -72.6 -28.6 62.88 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -58.84 -55.93 28.77 Favored 'General case' 0 CA--C 1.481 -1.693 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 172.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -46.66 -58.33 3.94 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 125.113 1.508 . . . . 0.0 111.333 175.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.12 -52.85 62.85 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 45.4 mm -65.14 -49.01 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-O 120.99 0.424 . . . . 0.0 110.102 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -60.92 -37.35 81.98 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.968 0.907 . . . . 0.0 112.047 -176.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . 0.42 ' HG3' ' OE1' ' A' ' 114' ' ' GLU . 14.0 mmmm -81.73 -42.18 20.2 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.95 -51.26 10.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.074 0.464 . . . . 0.0 111.588 -177.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.424 ' HE2' ' CB ' ' A' ' 87' ' ' GLU . 58.2 tttm . . . . . 0 C--N 1.32 -0.701 0 CA-C-O 122.356 1.074 . . . . 0.0 110.321 -175.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.443 ' HB3' HD13 ' A' ' 9' ' ' ILE . 11.1 tp . . . . . 0 N--CA 1.437 -1.104 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.5 p -82.65 153.76 25.24 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.255 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -53.62 -44.05 69.18 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 125.018 1.327 . . . . 0.0 110.959 -176.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -55.89 -49.01 74.6 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.107 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -68.57 -47.22 67.36 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.722 -178.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.615 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 60.3 mt -57.37 -40.24 73.02 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.464 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.329 -178.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.31 -49.03 79.38 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-O 120.792 0.33 . . . . 0.0 111.4 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -60.2 -41.18 92.43 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.637 0.732 . . . . 0.0 109.578 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.475 ' CE2' ' HG2' ' A' ' 72' ' ' MET . 36.5 m-85 -77.27 -13.62 59.9 Favored 'General case' 0 C--O 1.207 -1.156 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.615 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 97.7 mttt -69.64 -43.41 72.67 Favored 'General case' 0 C--O 1.249 1.059 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 173.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -64.64 -45.45 86.76 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.014 -0.993 . . . . 0.0 110.18 176.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.413 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -58.52 -47.88 82.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.356 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -57.03 -49.15 76.7 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.336 0.655 . . . . 0.0 111.196 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.3 m -76.99 -19.61 57.08 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.234 -174.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 15' ' ' ALA . 4.5 pp -79.21 -21.98 45.52 Favored 'General case' 0 CA--C 1.502 -0.9 0 C-N-CA 118.979 -1.088 . . . . 0.0 110.741 176.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.425 ' CE2' ' HA ' ' A' ' 32' ' ' LEU . 2.7 t80 -80.7 -50.85 9.37 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.46 79.72 3.17 Favored 'General case' 0 N--CA 1.416 -2.145 0 CA-C-N 113.012 -1.904 . . . . 0.0 110.47 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -54.58 -34.39 61.85 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 113.584 -1.644 . . . . 0.0 112.793 -175.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -92.87 -8.18 44.12 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.734 -170.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.5 37.12 94.02 Favored Glycine 0 C--O 1.235 0.208 0 C-N-CA 121.344 -0.455 . . . . 0.0 112.626 177.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -100.87 -16.2 17.32 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 122.755 -0.262 . . . . 0.0 111.288 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.5 6.96 76.59 Favored Glycine 0 N--CA 1.439 -1.126 0 C-N-CA 120.554 -0.831 . . . . 0.0 114.4 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.8 p -128.68 130.69 47.53 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 118.063 0.931 . . . . 0.0 109.737 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 51.2 mt -96.15 122.01 47.24 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.477 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.4 p -101.86 168.32 9.5 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.037 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -64.84 -27.74 69.08 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.131 0.491 . . . . 0.0 110.496 177.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -57.47 -57.16 13.87 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 177.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.49 -37.9 89.16 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 114.543 -1.208 . . . . 0.0 111.834 -176.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 28' ' ' THR . 96.4 mt -52.85 -62.84 1.39 Allowed 'General case' 0 CA--C 1.501 -0.932 0 O-C-N 124.237 0.961 . . . . 0.0 109.85 178.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.07 -28.52 71.56 Favored Glycine 0 N--CA 1.428 -1.861 0 C-N-CA 119.875 -1.155 . . . . 0.0 113.268 -176.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.3 m -60.82 -55.36 34.01 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 118.105 0.953 . . . . 0.0 111.007 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.69 -35.05 30.12 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.746 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.3 mtp -64.98 -37.29 87.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.419 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -64.85 -40.77 95.68 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 122.703 0.401 . . . . 0.0 110.027 176.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.4 m -65.4 -26.82 68.16 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.371 0.605 . . . . 0.0 110.339 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -94.72 8.98 40.68 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.785 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.407 ' HA3' ' HA3' ' A' ' 113' ' ' GLY . . . 87.03 35.54 9.72 Favored Glycine 0 C--N 1.312 -0.786 0 C-N-CA 120.032 -1.08 . . . . 0.0 115.719 172.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -143.16 121.78 12.53 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 172.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.428 ' N ' HD21 ' A' ' 42' ' ' ASN . 0.7 OUTLIER -116.06 84.49 13.71 Favored Pre-proline 0 C--N 1.309 -1.183 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.723 -178.884 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.439 ' HG2' HD21 ' A' ' 48' ' ' LEU . 19.1 Cg_endo -84.47 169.22 11.07 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.386 2.058 . . . . 0.0 111.655 176.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.0 p -96.48 170.3 9.31 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.848 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -56.49 -42.48 78.36 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.55 1.14 . . . . 0.0 110.368 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.24 -47.77 84.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.364 -178.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -63.73 -43.69 95.74 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.361 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.439 HD21 ' HG2' ' A' ' 43' ' ' PRO . 94.1 mt -62.7 -34.09 76.42 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.709 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -72.58 -34.39 67.42 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.69 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -65.68 -42.26 91.46 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.2 mtt -55.28 -42.84 74.1 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.655 177.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 33.3 mt -71.16 -56.52 10.27 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.612 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.815 176.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -54.22 -31.04 52.15 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -174.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.94 -42.5 89.96 Favored 'General case' 0 N--CA 1.415 -2.19 0 C-N-CA 124.009 0.924 . . . . 0.0 110.744 175.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.53 HG11 ' SD ' ' A' ' 71' ' ' MET . 9.5 m -102.84 -18.9 6.37 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.194 -175.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -68.63 109.7 3.9 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.56 -40.33 21.06 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.041 -173.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -94.44 -9.91 34.07 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.143 -176.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.88 53.24 31.83 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.977 177.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.2 p-10 -107.6 -9.71 15.82 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 120.65 -0.42 . . . . 0.0 111.241 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 106.95 -0.05 35.94 Favored Glycine 0 N--CA 1.439 -1.159 0 C-N-CA 120.386 -0.911 . . . . 0.0 113.306 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.5 p -135.27 151.33 50.47 Favored 'General case' 0 C--O 1.249 1.068 0 CA-C-N 117.609 0.705 . . . . 0.0 111.888 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.1 mt -93.71 110.34 23.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 175.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -82.49 175.11 10.47 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 177.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 59.8 t80 -61.08 -52.9 68.56 Favored Pre-proline 0 C--N 1.302 -1.487 0 CA-C-O 119.255 -0.403 . . . . 0.0 111.484 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.9 Cg_endo -53.02 -34.94 69.89 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.769 2.313 . . . . 0.0 112.522 174.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -74.39 -39.87 62.4 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -61.85 -42.54 99.17 Favored 'General case' 0 C--O 1.246 0.889 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 76.3 mt -60.47 -46.55 89.66 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.022 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.2 m -57.89 -42.22 84.18 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 123.52 0.512 . . . . 0.0 110.853 177.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.53 ' SD ' HG11 ' A' ' 55' ' ' VAL . 30.6 ttp -57.79 -45.92 85.35 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 121.021 0.439 . . . . 0.0 111.451 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.475 ' HG2' ' CE2' ' A' ' 12' ' ' PHE . 34.6 tpp -76.3 -33.74 59.06 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.222 -176.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.35 -21.73 62.0 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.745 -179.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -83.64 -27.49 29.09 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 121.549 0.69 . . . . 0.0 109.663 173.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -86.39 -38.66 17.17 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.302 -173.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.406 ' HG2' ' OE1' ' A' ' 84' ' ' GLU . 32.5 mtm . . . . . 0 CA--C 1.507 -0.684 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.99 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -60.46 -62.73 1.65 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.406 ' OE1' ' HG2' ' A' ' 76' ' ' MET . 45.3 mt-10 -67.04 -35.09 79.12 Favored 'General case' 0 CA--C 1.485 -1.539 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.315 -178.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 26.8 mm -61.13 -46.02 97.44 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.408 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.1 ttp-105 -67.97 -50.16 57.37 Favored 'General case' 0 C--O 1.196 -1.745 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.032 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -55.49 -39.2 70.12 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.5 86.81 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 120.501 0.191 . . . . 0.0 111.132 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -71.57 -49.15 43.28 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -56.59 -32.5 65.29 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 126.521 1.929 . . . . 0.0 112.485 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.52 -28.63 16.11 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 C-N-CA 120.197 -0.601 . . . . 0.0 111.304 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -81.6 -47.64 12.78 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 174.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -83.84 61.74 6.55 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 122.974 1.369 . . . . 0.0 107.452 175.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -77.84 -24.03 48.76 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.415 -172.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -93.49 -13.34 27.97 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.497 0.665 . . . . 0.0 110.359 -177.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.2 62.85 1.46 Allowed Glycine 0 N--CA 1.435 -1.372 0 C-N-CA 120.494 -0.86 . . . . 0.0 111.589 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -106.02 -19.26 13.78 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-O 121.587 0.708 . . . . 0.0 109.246 177.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.08 -13.38 59.73 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.672 175.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -139.7 132.32 28.84 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -176.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.459 ' HB ' HG11 ' A' ' 136' ' ' VAL . 3.7 mt -80.37 121.82 34.48 Favored 'Isoleucine or valine' 0 C--O 1.252 1.225 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.4 m -101.19 161.73 13.4 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 123.349 0.406 . . . . 0.0 109.978 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.12 -52.89 20.1 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -172.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.33 -29.98 69.68 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 121.73 0.776 . . . . 0.0 109.226 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.18 -39.85 93.44 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.307 -1.315 . . . . 0.0 110.499 175.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' A' ' 109' ' ' MET . 4.9 tt -64.85 -45.79 84.61 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 177.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.416 ' HG3' HG23 ' A' ' 121' ' ' VAL . 51.0 mtp180 -61.35 -35.67 78.06 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.919 -0.488 . . . . 0.0 111.67 175.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -61.37 -51.56 68.29 Favored 'General case' 0 C--O 1.259 1.587 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.818 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.618 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 10.5 p -65.59 -35.41 75.17 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.635 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.911 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.0 mmt -60.75 -40.18 91.5 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 56.8 m -59.87 -40.9 90.22 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 176.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -72.96 -26.82 61.51 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.491 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 81.8 mt -86.56 -7.45 58.36 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.166 0.507 . . . . 0.0 109.901 -178.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . 0.407 ' HA3' ' HA3' ' A' ' 40' ' ' GLY . . . 70.37 13.6 70.91 Favored Glycine 0 N--CA 1.432 -1.586 0 CA-C-N 115.085 -0.961 . . . . 0.0 113.168 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -86.84 -35.4 19.08 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp 57.15 94.78 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.307 1.043 . . . . 0.0 111.954 176.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 72.0 mt -110.91 155.86 22.03 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 120.894 0.378 . . . . 0.0 111.292 -176.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.0 p -85.37 161.12 19.6 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.607 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -64.26 -41.14 97.08 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -69.06 -33.36 73.45 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.646 0.736 . . . . 0.0 110.307 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -68.15 -51.59 44.19 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.583 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.416 HG23 ' HG3' ' A' ' 106' ' ' ARG . 16.7 m -67.79 -30.57 48.9 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.429 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.325 178.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.93 -44.01 90.89 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.299 178.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.97 -43.67 98.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 65.4 mtt -56.65 -55.0 39.58 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 124.01 0.819 . . . . 0.0 111.038 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 46.2 mm -58.11 -55.37 22.52 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.416 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.724 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 -58.14 -43.15 87.17 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 113.186 0.809 . . . . 0.0 113.186 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -76.09 -28.43 57.56 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.396 -176.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -80.12 -28.78 38.92 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.691 0.758 . . . . 0.0 110.076 177.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -76.42 85.45 3.16 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 122.118 0.961 . . . . 0.0 110.664 178.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.0 mt -78.01 -23.29 13.79 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.903 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -83.19 -10.97 58.3 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.907 0.384 . . . . 0.0 111.134 -175.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.34 37.55 70.6 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -94.97 -16.89 22.43 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 121.647 0.737 . . . . 0.0 109.417 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 97.47 -14.75 63.02 Favored Glycine 0 N--CA 1.444 -0.825 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -177.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -133.98 138.36 45.38 Favored 'General case' 0 CA--C 1.49 -1.361 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 178.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.459 HG11 ' HB ' ' A' ' 100' ' ' ILE . 0.7 OUTLIER -80.75 121.46 34.26 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 CA-C-O 121.183 0.516 . . . . 0.0 111.815 -177.904 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.566 ' HB3' ' OE2' ' A' ' 140' ' ' GLU . 50.8 t30 -87.99 166.67 14.32 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.925 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.529 ' O ' HG13 ' A' ' 142' ' ' VAL . 91.1 t80 -61.07 -45.44 94.71 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 123.223 0.609 . . . . 0.0 112.318 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.478 ' O ' HG22 ' A' ' 142' ' ' VAL . 15.1 mm-40 -65.41 -40.86 93.89 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.282 0.563 . . . . 0.0 111.732 -178.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.566 ' OE2' ' HB3' ' A' ' 137' ' ' ASN . 4.8 mp0 -60.54 -43.62 97.0 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.272 175.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -60.09 -47.04 87.55 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.881 176.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.529 HG13 ' O ' ' A' ' 138' ' ' TYR . 4.4 m -63.6 -39.2 84.47 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.491 -178.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -65.49 -42.5 92.1 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.042 -176.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.475 ' HG3' ' N ' ' A' ' 145' ' ' MET . 3.4 ptm -78.62 -37.55 41.94 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 119.937 -0.705 . . . . 0.0 111.726 -178.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.475 ' N ' ' HG3' ' A' ' 144' ' ' MET . 3.0 tmm? . . . . . 0 C--N 1.316 -0.874 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.999 -171.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 mttt . . . . . 0 CA--C 1.513 -0.473 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -73.54 -43.06 60.84 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 176.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.68 -34.86 65.07 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.857 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -73.43 -36.11 65.89 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -58.57 -53.88 53.39 Favored 'General case' 0 CA--C 1.493 -1.214 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 174.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -57.52 -40.19 78.18 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 114.553 -1.203 . . . . 0.0 112.756 176.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.85 -54.72 38.29 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 122.46 0.304 . . . . 0.0 111.382 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.577 ' O ' ' HB3' ' B' ' 93' ' ' LYS . 44.3 pt -64.33 -35.82 75.29 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 CA-C-O 120.941 0.4 . . . . 0.0 110.611 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -69.59 -41.16 76.15 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.421 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -65.34 -45.49 84.02 Favored 'General case' 0 C--O 1.205 -1.248 0 C-N-CA 122.701 0.401 . . . . 0.0 110.508 -177.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.6 -47.55 11.97 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -175.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.577 ' HB3' ' O ' ' B' ' 89' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.473 0.725 0 CA-C-O 121.529 0.68 . . . . 0.0 112.083 -177.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 tp . . . . . 0 N--CA 1.441 -0.905 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 45.5 p -80.73 156.2 26.36 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.869 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -57.22 -33.33 67.43 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 123.45 0.7 . . . . 0.0 112.345 -174.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 2.0 mp0 -61.01 -46.2 91.73 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.022 0.915 . . . . 0.0 109.293 178.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.457 ' O ' ' HB3' ' A' ' 11' ' ' GLU . 62.0 tt0 -75.08 -33.17 61.62 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 114.623 -1.172 . . . . 0.0 110.14 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.618 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 67.3 mt -63.98 -37.32 79.5 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.57 -40.89 88.83 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 122.631 0.372 . . . . 0.0 110.725 175.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.457 ' HB3' ' O ' ' A' ' 8' ' ' GLN . 10.3 tp10 -57.13 -50.75 71.84 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 174.6 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -62.68 -30.27 71.27 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.936 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.618 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 91.1 mttt -62.14 -48.26 80.89 Favored 'General case' 0 C--O 1.252 1.224 0 CA-C-O 121.243 0.544 . . . . 0.0 110.477 179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -71.98 -43.73 64.66 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.103 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.56 -48.58 74.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.927 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.54 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 56.7 t80 -58.15 -55.34 36.28 Favored 'General case' 0 C--O 1.189 -2.098 0 C-N-CA 124.082 0.953 . . . . 0.0 110.425 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.9 m -68.72 -17.02 63.99 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 123.402 0.438 . . . . 0.0 111.677 -174.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.87 -43.25 84.05 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 174.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.498 ' CE1' ' HA ' ' A' ' 16' ' ' PHE . 35.2 p90 -96.6 -24.06 16.21 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 119.713 -0.795 . . . . 0.0 111.945 -178.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -79.18 81.55 5.43 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 168.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -58.45 -31.43 67.77 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.466 -1.697 . . . . 0.0 114.241 -169.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.414 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 34.3 m-20 -88.05 -13.0 42.66 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.311 -0.956 . . . . 0.0 111.845 178.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.94 61.09 6.77 Favored Glycine 0 CA--C 1.518 0.233 0 O-C-N 123.285 0.365 . . . . 0.0 112.318 -179.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.414 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 5.3 m-20 -111.09 -16.8 13.39 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.108 0.48 . . . . 0.0 109.889 -175.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.8 13.87 64.02 Favored Glycine 0 C--O 1.215 -1.087 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -174.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.599 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 17.2 p -143.41 138.42 29.34 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 122.989 0.516 . . . . 0.0 109.973 177.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mt -104.81 127.7 59.08 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 177.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.7 p -98.86 171.55 8.0 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.1 p -58.93 -39.41 81.49 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 120.984 0.421 . . . . 0.0 110.502 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -50.66 -55.1 17.98 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.014 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -66.82 -44.29 81.53 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.755 -174.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 75.6 mt -53.6 -51.68 62.26 Favored 'General case' 0 CA--C 1.51 -0.579 0 O-C-N 123.851 0.719 . . . . 0.0 111.105 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.532 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -72.9 -37.02 57.09 Favored Glycine 0 C--O 1.192 -2.471 0 C-N-CA 119.25 -1.452 . . . . 0.0 112.832 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.2 m -58.73 -48.36 81.44 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-N 118.593 1.196 . . . . 0.0 110.716 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.464 HG13 ' HB2' ' A' ' 19' ' ' PHE . 17.0 m -67.59 -34.71 69.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.31 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.3 mtm -73.37 -37.0 66.18 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 31.2 mtm180 -66.43 -30.31 70.64 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.7 m -71.74 -30.68 65.88 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.496 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.7 mt -84.07 -15.18 48.36 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.816 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.5 37.1 1.97 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.697 -0.764 . . . . 0.0 114.633 175.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -148.42 131.17 16.0 Favored 'General case' 0 CA--C 1.503 -0.858 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 173.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -114.98 80.36 6.74 Favored Pre-proline 0 C--N 1.31 -1.133 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.639 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -76.12 154.44 37.33 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.154 1.903 . . . . 0.0 110.688 175.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.591 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 51.8 p -83.31 164.05 20.29 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -178.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -66.56 -27.1 67.47 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 -177.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.24 -45.13 91.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.313 0.577 . . . . 0.0 109.685 175.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' A' ' 51' ' ' MET . 34.5 mt-10 -67.49 -48.3 67.51 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.621 178.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 44' ' ' THR . 73.9 mt -57.27 -41.32 79.46 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.162 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 -70.42 -35.59 73.51 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.02 -178.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.47 -41.01 85.3 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.458 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 66.4 mtt -54.89 -46.07 74.77 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.194 176.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 67.6 mt -67.19 -55.11 18.82 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.778 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.311 178.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -55.72 -32.64 63.52 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -171.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -61.73 -36.75 81.88 Favored 'General case' 0 N--CA 1.385 -3.707 0 C-N-CA 123.408 0.683 . . . . 0.0 112.587 178.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.447 HG13 ' SD ' ' A' ' 71' ' ' MET . 34.5 m -98.43 -13.95 7.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-O 120.909 0.385 . . . . 0.0 110.149 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -79.21 105.61 10.66 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.89 -177.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.49 -9.31 56.48 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.964 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.17 -11.8 31.88 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.197 -176.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.99 37.59 91.68 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.799 -176.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -115.17 -14.96 11.71 Favored 'General case' 0 C--N 1.32 -0.712 0 O-C-N 122.673 -0.31 . . . . 0.0 111.248 -176.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.23 23.16 32.78 Favored Glycine 0 N--CA 1.433 -1.517 0 C-N-CA 120.438 -0.886 . . . . 0.0 113.385 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.7 p -133.57 136.74 45.12 Favored 'General case' 0 C--O 1.252 1.203 0 CA-C-N 117.37 0.585 . . . . 0.0 111.379 178.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.599 ' O ' ' HA ' ' A' ' 26' ' ' THR . 51.2 mt -91.69 110.74 23.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.121 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -75.35 154.9 37.01 Favored 'General case' 0 C--N 1.279 -2.461 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.415 ' CZ ' ' HG2' ' A' ' 13' ' ' LYS . 63.1 t80 -51.41 -51.62 67.27 Favored Pre-proline 0 C--N 1.311 -1.093 0 O-C-N 123.422 0.451 . . . . 0.0 111.668 176.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.2 Cg_endo -49.98 -40.74 49.52 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.707 2.272 . . . . 0.0 112.397 172.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -69.6 -40.64 76.54 Favored 'General case' 0 C--O 1.22 -0.449 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.545 ' CE1' ' HE1' ' A' ' 72' ' ' MET . 38.4 t80 -58.55 -40.49 83.17 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.205 0.602 . . . . 0.0 109.563 174.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 94.1 mt -64.94 -51.6 60.93 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.747 176.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 74.3 m -57.04 -45.87 82.84 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.826 0.45 . . . . 0.0 111.018 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.447 ' SD ' HG13 ' A' ' 55' ' ' VAL . 26.9 ttp -58.68 -44.09 90.15 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.49 0.716 . . . . 0.0 111.642 178.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.545 ' HE1' ' CE1' ' A' ' 68' ' ' PHE . 2.5 tpp -74.61 -36.3 62.95 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.153 -177.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.22 -48.57 80.86 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.269 177.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -70.12 -16.44 63.11 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.409 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -88.82 -16.25 32.52 Favored 'General case' 0 C--N 1.297 -1.716 0 C-N-CA 123.032 0.533 . . . . 0.0 111.632 178.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.9 ttp . . . . . 0 C--O 1.244 0.812 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 -167.266 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 . . . . . 0 N--CA 1.418 -2.031 0 CA-C-O 120.662 0.267 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -68.85 -38.46 79.81 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.76 -173.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -56.76 -38.21 72.14 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.214 0.53 . . . . 0.0 110.058 175.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.432 ' CD1' ' HG2' ' A' ' 145' ' ' MET . 15.0 mm -68.2 -46.83 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.693 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.5 ttm180 -71.02 -29.73 65.74 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 114.314 -1.312 . . . . 0.0 112.588 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -68.06 -44.47 76.27 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.504 0.669 . . . . 0.0 109.625 174.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.453 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -68.52 -24.29 64.63 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.741 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -81.46 -42.01 20.95 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 121.121 0.486 . . . . 0.0 109.903 176.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -57.39 -33.23 67.62 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.072 1.349 . . . . 0.0 112.612 -177.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.453 HG12 ' O ' ' A' ' 88' ' ' ALA . 11.6 p -58.42 -31.08 42.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.255 178.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.427 ' HB3' HG21 ' A' ' 100' ' ' ILE . 61.2 m-85 -93.86 -60.93 1.64 Allowed 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -85.79 87.19 7.37 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 122.313 1.054 . . . . 0.0 110.149 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -78.51 -39.89 36.77 Favored 'General case' 0 C--N 1.288 -2.077 0 CA-C-N 113.399 -1.728 . . . . 0.0 111.259 -175.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -79.79 -13.15 59.63 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.919 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.87 50.88 5.35 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.309 -0.948 . . . . 0.0 110.921 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -97.9 -12.63 21.86 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-O 121.268 0.556 . . . . 0.0 109.835 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.4 ' O ' ' HA ' ' A' ' 137' ' ' ASN . . . 78.79 20.42 70.95 Favored Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.935 176.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.412 ' HA ' ' O ' ' A' ' 136' ' ' VAL . 21.8 p90 -150.52 154.89 38.43 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 117.037 0.418 . . . . 0.0 110.669 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.455 ' HB ' HG11 ' A' ' 136' ' ' VAL . 4.2 mt -110.65 137.62 42.27 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 177.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 14.8 m -116.69 154.72 30.09 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 123.973 0.796 . . . . 0.0 109.507 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.71 -44.15 82.43 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -175.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.68 -49.16 76.23 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.643 0.258 . . . . 0.0 110.945 -178.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -55.42 -46.62 76.65 Favored 'General case' 0 CA--C 1.501 -0.928 0 C-N-CA 123.164 0.586 . . . . 0.0 110.33 176.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.4 tt -59.16 -44.65 92.14 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-N 115.087 -0.96 . . . . 0.0 108.899 -173.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.49 ' HG3' HG23 ' A' ' 121' ' ' VAL . 33.0 mtp180 -62.29 -37.19 84.58 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 120.977 0.418 . . . . 0.0 111.805 174.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -60.96 -44.94 96.59 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.663 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 8.9 p -72.84 -31.39 36.09 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.213 0 C-N-CA 119.71 -0.796 . . . . 0.0 110.375 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.8 mmt -64.22 -44.73 90.98 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-O 120.57 0.224 . . . . 0.0 111.433 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 22.2 m -61.41 -33.55 73.88 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.245 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -75.21 -31.58 60.94 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.918 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.9 mt -81.88 -18.36 44.06 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.647 0.737 . . . . 0.0 109.904 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 86.09 21.93 50.62 Favored Glycine 0 N--CA 1.433 -1.552 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.54 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -101.6 122.28 43.56 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -83.16 107.88 16.03 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 123.475 0.484 . . . . 0.0 110.135 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 20.8 mt -124.97 152.13 44.57 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 176.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 50.9 p -87.06 174.5 8.62 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -71.65 -30.09 65.35 Favored 'General case' 0 C--O 1.207 -1.134 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 175.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.9 -49.45 77.41 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.559 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -56.86 -55.22 37.22 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.166 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.49 HG23 ' HG3' ' A' ' 106' ' ' ARG . 11.3 m -68.5 -32.0 53.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.372 -175.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -67.42 -44.9 77.65 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -63.87 -39.7 94.81 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 123.472 0.483 . . . . 0.0 110.337 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.3 mtt -52.6 -54.16 36.81 Favored 'General case' 0 CA--C 1.499 -0.989 0 O-C-N 124.133 0.896 . . . . 0.0 110.452 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mm -65.39 -55.73 18.75 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.192 0 O-C-N 123.777 0.673 . . . . 0.0 110.448 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 50.7 ttt180 -49.06 -47.07 45.25 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 125.145 1.378 . . . . 0.0 113.989 -173.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -82.8 -27.2 31.11 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.665 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.86 -19.96 47.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 122.309 1.052 . . . . 0.0 109.454 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.23 74.51 1.3 Allowed 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.643 176.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.1 mt -75.89 -14.65 15.22 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 CA-C-N 114.342 -1.299 . . . . 0.0 107.922 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -81.66 -10.29 59.44 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.695 -1.139 . . . . 0.0 109.788 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 59.97 31.34 72.15 Favored Glycine 0 C--N 1.34 0.773 0 CA-C-N 115.013 -0.994 . . . . 0.0 113.757 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -115.42 -11.72 11.81 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 121.531 0.681 . . . . 0.0 111.15 -173.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 94.81 14.78 48.34 Favored Glycine 0 C--N 1.304 -1.201 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -177.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -143.71 124.51 14.22 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.455 HG11 ' HB ' ' A' ' 100' ' ' ILE . 0.9 OUTLIER -88.79 112.86 24.62 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.88 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.988 179.203 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.4 ' HA ' ' O ' ' A' ' 98' ' ' GLY . 48.4 m-80 -81.84 160.99 23.37 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.939 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -57.24 -42.36 81.3 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.692 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -62.22 -21.58 65.25 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -87.87 -44.91 10.72 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -62.97 -38.45 91.16 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.376 -1.284 . . . . 0.0 112.609 -177.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 25.5 m -57.14 -30.43 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-O 121.18 0.515 . . . . 0.0 111.982 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -79.28 -26.38 42.35 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 121.495 0.664 . . . . 0.0 111.178 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 85.5 mtp -80.06 -19.13 48.26 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.898 -175.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.432 ' HG2' ' CD1' ' A' ' 85' ' ' ILE . 58.4 tpp . . . . . 0 C--N 1.32 -0.702 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . 0.489 ' HE3' ' OE1' ' B' ' 83' ' ' GLU . 2.9 tmmm? . . . . . 0 N--CA 1.446 -0.632 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . 0.489 ' OE1' ' HE3' ' B' ' 82' ' ' LYS . 11.9 mm-40 -65.9 -26.85 67.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.521 0.201 . . . . 0.0 111.326 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.72 -56.07 26.46 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 172.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.483 ' O ' HG12 ' B' ' 89' ' ' ILE . 60.4 m95 -61.51 -42.55 98.98 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.186 176.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . 0.406 ' HG2' ' OE1' ' B' ' 83' ' ' GLU . 19.0 tptm -49.0 -55.18 12.72 Favored 'General case' 0 CA--C 1.501 -0.904 0 C-N-CA 125.424 1.49 . . . . 0.0 110.057 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -63.42 -46.43 86.39 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.305 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.16 -52.52 65.35 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 123.538 0.524 . . . . 0.0 112.387 -177.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 85' ' ' TRP . 29.3 pt -68.92 -29.18 42.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.129 0.49 . . . . 0.0 111.225 -177.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -78.25 -42.77 30.1 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.652 -179.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 12.0 tppt? -55.28 -37.65 67.58 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.063 1.345 . . . . 0.0 109.235 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.43 -31.49 72.66 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.54 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 94.5 mttt . . . . . 0 N--CA 1.433 -1.308 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.638 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' A' ' 9' ' ' ILE . 11.4 tp . . . . . 0 N--CA 1.421 -1.905 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.473 ' O ' HG13 ' A' ' 9' ' ' ILE . 34.5 p -86.76 143.52 27.48 Favored 'General case' 0 N--CA 1.42 -1.929 0 C-N-CA 123.214 0.606 . . . . 0.0 110.811 -177.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -52.19 -46.76 65.68 Favored 'General case' 0 C--O 1.244 0.786 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -174.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -60.32 -46.32 90.29 Favored 'General case' 0 CA--C 1.512 -0.488 0 O-C-N 123.269 0.356 . . . . 0.0 110.548 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 -66.13 -37.84 86.7 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.659 -178.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.492 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 30.5 mt -63.5 -43.01 98.17 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.0 177.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.79 -41.83 91.47 Favored 'General case' 0 C--O 1.259 1.584 0 CA-C-O 121.399 0.618 . . . . 0.0 110.935 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -60.68 -43.82 97.25 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.126 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.418 ' CZ ' ' HG3' ' A' ' 72' ' ' MET . 19.4 m-85 -62.92 -40.83 98.8 Favored 'General case' 0 C--O 1.168 -3.234 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.984 175.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.492 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -47.99 -52.54 19.41 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.388 0.613 . . . . 0.0 111.987 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -66.75 -48.14 70.02 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.0 -177.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.05 -31.53 69.19 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.434 0.635 . . . . 0.0 111.902 -177.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -65.41 -40.3 93.21 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 124.591 1.156 . . . . 0.0 109.702 177.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 26.1 m -69.87 -25.51 63.75 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.066 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -70.89 -43.19 68.86 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -66.04 -43.05 88.65 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.339 178.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -69.76 101.27 1.66 Allowed 'General case' 0 C--N 1.313 -1.017 0 O-C-N 123.947 0.779 . . . . 0.0 109.848 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -77.19 1.92 16.98 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -109.44 -13.78 14.53 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 175.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.39 24.54 73.67 Favored Glycine 0 N--CA 1.437 -1.234 0 CA-C-N 114.608 -1.178 . . . . 0.0 112.164 -176.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -98.95 -18.54 17.78 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 119.572 -0.851 . . . . 0.0 112.205 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.25 29.73 7.77 Favored Glycine 0 C--N 1.307 -1.033 0 C-N-CA 120.677 -0.773 . . . . 0.0 114.603 175.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.8 p -145.43 129.86 17.81 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 173.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 51.6 mt -101.7 115.45 43.51 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.987 -177.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.9 p -84.66 178.01 7.83 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.522 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.7 p -64.83 -29.25 70.2 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.475 0.655 . . . . 0.0 109.55 176.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -59.23 -57.85 11.2 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.772 177.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -64.48 -39.4 93.73 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 114.265 -1.334 . . . . 0.0 111.093 -177.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.5 mt -56.17 -57.5 11.91 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 123.373 0.421 . . . . 0.0 110.548 175.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.72 -31.31 79.66 Favored Glycine 0 C--O 1.211 -1.285 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.366 -178.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.9 m -69.13 -46.99 66.26 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 116.839 0.32 . . . . 0.0 110.825 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 28.4 m -70.69 -28.64 34.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 121.306 0.575 . . . . 0.0 110.755 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.517 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 22.2 mtt -68.81 -40.81 79.35 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 173.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -66.35 -30.57 71.0 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 123.851 0.86 . . . . 0.0 110.891 178.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.7 m -64.53 -25.95 68.21 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.462 0.649 . . . . 0.0 110.132 176.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -106.34 13.92 28.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.023 178.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.1 34.65 41.01 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 115.386 0.914 . . . . 0.0 115.386 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.431 ' C ' HD21 ' A' ' 42' ' ' ASN . 4.8 tt0 -131.22 129.84 42.15 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 118.295 1.047 . . . . 0.0 109.853 176.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.431 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.82 86.02 45.36 Favored Pre-proline 0 C--N 1.305 -1.347 0 O-C-N 122.126 -0.359 . . . . 0.0 110.489 176.75 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.517 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 16.6 Cg_exo -70.02 163.62 37.82 Favored 'Trans proline' 0 C--O 1.246 0.905 0 C-N-CA 122.992 2.461 . . . . 0.0 111.96 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.487 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 44.0 p -73.85 142.96 46.06 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 174.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -72.13 -19.08 61.84 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.034 -174.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.83 -39.72 92.8 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.095 174.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.487 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 37.8 mm-40 -65.14 -42.54 93.71 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 69.9 mt -65.89 -40.55 91.65 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.82 -1.082 . . . . 0.0 112.983 -175.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.29 -44.96 93.56 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.82 177.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -64.16 -38.04 89.61 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.984 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 38.4 tpp -60.11 -50.89 71.91 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.977 -1.011 . . . . 0.0 109.798 178.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.8 mt -60.79 -51.79 69.1 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.483 177.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -63.92 -13.4 45.29 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -173.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -72.28 -40.99 67.2 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.406 HG12 ' HB2' ' A' ' 71' ' ' MET . 22.0 m -97.24 -21.98 5.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.211 -176.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -72.36 112.08 8.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.299 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.51 -27.12 24.2 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-O 121.194 0.521 . . . . 0.0 110.914 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.33 -11.81 31.5 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -174.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.52 58.68 12.67 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.414 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -102.88 -16.83 15.77 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.2 23.35 34.91 Favored Glycine 0 N--CA 1.419 -2.451 0 N-CA-C 108.83 -1.708 . . . . 0.0 108.83 -173.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 49.4 p -140.35 137.13 33.84 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-N 115.567 -0.316 . . . . 0.0 111.039 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 57.5 mt -91.03 104.77 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.538 0 N-CA-C 104.269 -2.493 . . . . 0.0 104.269 173.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -84.0 168.17 16.2 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.544 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 57.8 t80 -52.87 -56.01 27.61 Favored Pre-proline 0 CA--C 1.554 1.128 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -175.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.75 -39.79 75.95 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 122.621 2.214 . . . . 0.0 112.547 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -70.38 -37.6 74.57 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.309 0.576 . . . . 0.0 110.056 -177.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -62.76 -41.97 99.47 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 72.2 mt -62.24 -49.28 76.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.014 178.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.1 m -56.87 -42.8 80.44 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.356 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.406 ' HB2' HG12 ' A' ' 55' ' ' VAL . 32.1 ttp -58.76 -46.68 86.9 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.165 0.586 . . . . 0.0 111.689 178.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.418 ' HG3' ' CZ ' ' A' ' 12' ' ' PHE . 23.2 mmt -71.76 -37.39 70.5 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.716 -177.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.31 -43.19 99.4 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -63.39 -28.94 70.33 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.69 176.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -69.01 -38.3 79.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 62.9 mtt . . . . . 0 C--N 1.318 -0.802 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.51 179.226 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 . . . . . 0 C--O 1.222 -0.394 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -66.33 -50.11 64.71 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 120.839 0.352 . . . . 0.0 111.668 -172.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -84.68 -26.0 28.04 Favored 'General case' 0 CA--C 1.494 -1.186 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.991 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 4.9 mm -72.79 -36.69 53.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.733 -175.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -73.13 -30.94 63.97 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 176.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -67.99 -46.18 72.01 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.93 -27.91 69.17 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.024 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -76.55 -46.3 26.96 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -57.48 -38.7 74.97 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.529 1.132 . . . . 0.0 111.43 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.59 ' O ' ' HE2' ' A' ' 94' ' ' LYS . 11.6 p -68.06 -19.85 25.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.754 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -96.19 -52.39 4.03 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.742 177.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -80.46 100.94 8.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.576 0.703 . . . . 0.0 111.073 -178.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.59 ' HE2' ' O ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -78.52 -24.04 45.97 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.487 -0.779 . . . . 0.0 113.081 -179.424 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.91 -13.89 52.37 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.556 -0.858 . . . . 0.0 110.523 -176.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.28 43.26 95.49 Favored Glycine 0 CA--C 1.499 -0.924 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 178.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -101.61 -19.27 15.52 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 120.951 0.405 . . . . 0.0 110.603 -174.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.96 11.52 60.1 Favored Glycine 0 C--N 1.314 -0.684 0 C-N-CA 119.517 -1.325 . . . . 0.0 111.366 -179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.475 ' HB3' HE21 ' A' ' 135' ' ' GLN . 51.9 m-85 -140.93 130.74 24.31 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.0 mt -103.59 133.74 46.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.8 t -100.95 158.94 15.62 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.88 -42.56 76.83 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 177.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.18 -33.52 75.65 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.772 177.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.504 ' O ' ' HB3' ' A' ' 107' ' ' HIS . 4.2 tp10 -65.52 -49.44 68.98 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 174.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.542 ' O ' ' HG2' ' A' ' 109' ' ' MET . 22.0 mt -56.52 -48.23 77.66 Favored 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.4 -176.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -56.1 -43.96 78.57 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . 0.504 ' HB3' ' O ' ' A' ' 104' ' ' GLU . 6.8 t-80 -52.87 -55.71 21.15 Favored 'General case' 0 C--O 1.254 1.316 0 C-N-CA 123.996 0.918 . . . . 0.0 111.365 176.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.448 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.6 p -73.24 -33.51 41.64 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.641 0 C-N-CA 120.243 -0.583 . . . . 0.0 111.494 -176.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.542 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.2 mmt -64.87 -43.71 92.05 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 122.432 0.293 . . . . 0.0 111.279 -178.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.6 m -62.04 -35.5 78.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -73.04 -27.21 61.62 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.113 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 78.0 mt -89.14 -21.18 23.47 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.03 -0.419 . . . . 0.0 111.73 -177.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.51 20.27 13.81 Favored Glycine 0 C--N 1.312 -0.794 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.21 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.479 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 1.4 mp0 -100.32 110.68 22.91 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 123.476 0.71 . . . . 0.0 109.779 178.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -82.03 69.63 8.78 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 122.236 1.017 . . . . 0.0 111.591 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.606 HD12 ' SD ' ' A' ' 124' ' ' MET . 56.6 mt -101.85 139.32 37.65 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 177.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 40.2 p -84.58 171.33 12.55 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.38 -31.89 73.17 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -66.15 -51.21 60.05 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.813 177.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' A' ' 124' ' ' MET . 29.0 tt0 -66.56 -42.87 86.41 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.877 -176.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.512 ' HA ' ' SD ' ' A' ' 124' ' ' MET . 23.1 m -66.12 -31.36 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 120.429 -0.509 . . . . 0.0 111.169 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -68.06 -38.86 82.92 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.484 0.659 . . . . 0.0 109.702 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -66.38 -32.41 73.77 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.335 175.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.606 ' SD ' HD12 ' A' ' 116' ' ' LEU . 92.6 mtp -63.58 -45.01 92.38 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 174.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.3 mm -57.58 -50.25 77.89 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.144 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.246 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.2 ttp180 -59.28 -25.01 63.73 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 124' ' ' MET . 30.2 mm-40 -65.83 -48.88 70.16 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.974 0.416 . . . . 0.0 111.448 173.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -91.81 -23.45 19.7 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -173.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.499 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 30.2 t70 -72.8 96.28 2.04 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 176.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.0 mt -83.53 -53.08 12.1 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.559 -176.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -79.6 -9.66 59.66 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -173.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.499 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 81.37 55.91 3.12 Favored Glycine 0 C--N 1.307 -1.041 0 C-N-CA 120.746 -0.74 . . . . 0.0 113.482 173.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -104.37 -16.18 15.2 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 98.0 -5.01 61.25 Favored Glycine 0 CA--C 1.494 -1.247 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.475 HE21 ' HB3' ' A' ' 99' ' ' TYR . 28.9 mt-30 -143.59 127.08 16.88 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -76.05 128.43 37.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 123.795 0.684 . . . . 0.0 112.769 -176.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.2 m-80 -83.83 162.28 20.63 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.429 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -64.89 -39.06 92.94 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.73 -21.7 63.44 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.552 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -88.18 -39.92 14.12 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -62.88 -42.83 99.91 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.835 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 27.6 m -62.07 -30.83 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-O 121.077 0.465 . . . . 0.0 111.132 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -48.88 31.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 25.7 ttt -60.54 -42.18 95.99 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.996 0.427 . . . . 0.0 110.765 178.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 41.2 tpp . . . . . 0 CA--C 1.545 0.757 0 C-N-CA 123.742 0.817 . . . . 0.0 112.362 179.515 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? . . . . . 0 N--CA 1.441 -0.883 0 CA-C-O 121.657 0.741 . . . . 0.0 109.165 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.28 -26.26 64.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.689 -176.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.13 95.5 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.558 ' O ' HG12 ' B' ' 89' ' ' ILE . 86.0 m95 -65.75 -48.56 71.44 Favored 'General case' 0 CA--C 1.496 -1.097 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.063 176.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -55.93 -45.14 78.85 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 124.003 0.814 . . . . 0.0 110.771 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 27.0 m80 -61.72 -56.93 14.38 Favored 'General case' 0 C--O 1.206 -1.204 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.033 176.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.43 -51.85 63.64 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.628 ' O ' ' HE3' ' B' ' 93' ' ' LYS . 37.8 pt -62.57 -43.3 98.32 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.164 -177.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -71.78 -42.98 66.48 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.0 -178.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . 0.479 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 21.4 tptm -56.37 -44.49 80.2 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 125.035 1.334 . . . . 0.0 111.587 178.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . 0.404 ' HB1' HG22 ' A' ' 91' ' ' VAL . . . -63.22 -32.93 74.46 Favored 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.637 -178.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.628 ' HE3' ' O ' ' B' ' 89' ' ' ILE . 8.5 mtmp? . . . . . 0 C--N 1.312 -1.043 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -174.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.8 tp . . . . . 0 N--CA 1.439 -0.989 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.7 p -90.12 143.82 26.44 Favored 'General case' 0 C--N 1.303 -1.42 0 C-N-CA 122.877 0.471 . . . . 0.0 111.718 -178.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.423 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 2.4 mp0 -46.54 -55.12 8.06 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 125.606 1.562 . . . . 0.0 113.342 -175.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -61.39 -40.8 95.68 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.188 0.595 . . . . 0.0 111.074 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.441 ' O ' ' HD2' ' A' ' 12' ' ' PHE . 6.3 tp-100 -65.81 -41.65 91.61 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.482 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 69.4 mt -63.33 -35.61 72.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.556 177.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.92 -39.12 87.29 Favored 'General case' 0 C--O 1.257 1.449 0 CA-C-O 121.093 0.473 . . . . 0.0 110.576 177.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -60.22 -48.38 81.98 Favored 'General case' 0 C--O 1.247 0.945 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 175.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.441 ' HD2' ' O ' ' A' ' 8' ' ' GLN . 28.2 m-85 -56.6 -46.52 80.82 Favored 'General case' 0 C--O 1.184 -2.393 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.727 175.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 33.9 mmtp -46.82 -49.83 19.38 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.501 0.721 . . . . 0.0 112.073 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -65.51 -57.27 8.64 Favored 'General case' 0 C--O 1.255 1.379 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.074 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.51 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -68.15 -28.54 67.39 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.806 -175.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.8 -42.58 99.19 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 123.176 0.59 . . . . 0.0 109.78 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.4 m -72.59 -18.23 61.62 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.111 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.51 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 62.8 tp -68.9 -42.18 77.23 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.099 0.475 . . . . 0.0 110.198 172.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -78.95 -35.97 42.37 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.143 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -77.17 99.32 5.38 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.683 175.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -74.42 -3.08 28.4 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.331 -0.85 . . . . 0.0 113.277 -174.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.406 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 21.6 m-20 -110.95 -13.26 14.14 Favored 'General case' 0 CA--C 1.49 -1.363 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.729 -179.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.41 23.18 68.23 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 -176.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.406 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 3.9 p-10 -97.25 -16.36 20.39 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.891 0.377 . . . . 0.0 110.044 -173.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 101.98 8.35 45.17 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 114.851 0.701 . . . . 0.0 114.851 176.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.4 p -130.53 136.55 49.05 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 118.471 1.136 . . . . 0.0 109.628 177.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.1 mt -102.89 114.64 43.05 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 176.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.0 p -87.12 172.24 10.1 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.469 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.8 p -65.79 -32.83 74.58 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.128 0.489 . . . . 0.0 110.218 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -62.43 -45.95 90.76 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.589 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -66.6 -41.65 88.09 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.74 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.432 ' HB3' ' SD ' ' A' ' 36' ' ' MET . 89.7 mt -55.64 -62.1 1.91 Allowed 'General case' 0 CA--C 1.501 -0.929 0 O-C-N 124.006 0.816 . . . . 0.0 109.874 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.4 -29.12 65.75 Favored Glycine 0 C--O 1.2 -1.974 0 C-N-CA 121.18 -0.533 . . . . 0.0 113.422 -175.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.1 m -73.61 -46.2 48.4 Favored 'General case' 0 CA--C 1.554 1.128 0 CA-C-N 117.606 0.703 . . . . 0.0 111.354 178.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.97 -28.21 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 121.771 0.796 . . . . 0.0 109.97 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.432 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 48.3 mtp -77.68 -28.73 51.16 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.344 177.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -68.57 -29.08 67.55 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.0 m -65.2 -35.45 81.1 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.157 173.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -82.65 -22.44 34.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.142 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.74 25.02 5.59 Favored Glycine 0 N--CA 1.435 -1.414 0 C-N-CA 120.816 -0.706 . . . . 0.0 114.236 178.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -139.53 122.6 16.8 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 118.105 0.953 . . . . 0.0 109.476 176.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -141.11 89.85 9.52 Favored Pre-proline 0 C--N 1.298 -1.64 0 CA-C-O 121.71 0.766 . . . . 0.0 111.334 174.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -75.95 172.42 16.31 Favored 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.785 2.324 . . . . 0.0 112.126 178.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 p -73.07 164.33 26.85 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.941 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -52.76 -46.81 67.67 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.802 1.241 . . . . 0.0 111.095 -176.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.46 -43.4 83.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.289 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -64.19 -43.14 95.97 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.25 0.548 . . . . 0.0 110.546 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.2 mt -68.55 -47.08 67.77 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.76 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -58.67 -46.1 87.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.47 0.653 . . . . 0.0 109.531 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -62.57 -30.86 71.63 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.6 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 34.9 tpp -83.04 -39.51 21.14 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.9 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 42.4 mt -57.74 -42.98 83.0 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 176.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -56.05 -18.42 9.54 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 124.272 1.029 . . . . 0.0 113.546 -177.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -70.14 -43.76 70.25 Favored 'General case' 0 N--CA 1.393 -3.323 0 O-C-N 121.667 -0.646 . . . . 0.0 110.717 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.413 HG13 ' SD ' ' A' ' 71' ' ' MET . 12.2 m -95.29 -25.29 4.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.202 0.525 . . . . 0.0 110.095 -177.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -67.86 115.94 7.96 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.776 -176.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.12 -27.99 57.29 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.155 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -94.55 -12.45 27.55 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -174.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.03 37.56 63.36 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -173.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.5 p-10 -104.04 -7.58 20.19 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -171.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.78 23.18 11.08 Favored Glycine 0 C--N 1.307 -1.052 0 C-N-CA 120.195 -1.002 . . . . 0.0 113.818 172.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.55 132.66 21.61 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 116.819 0.31 . . . . 0.0 110.484 177.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 52.6 mt -92.39 110.05 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 176.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -85.34 178.43 7.47 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -63.07 -54.79 43.04 Favored Pre-proline 0 C--N 1.298 -1.649 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -174.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -52.11 -40.05 69.38 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.616 2.21 . . . . 0.0 112.654 175.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -66.12 -40.85 90.99 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.4 0.619 . . . . 0.0 109.795 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -64.18 -40.88 97.05 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.94 177.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.1 mt -61.05 -48.45 81.68 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.56 176.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.6 m -56.92 -44.66 82.65 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 123.427 0.454 . . . . 0.0 110.257 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.413 ' SD ' HG13 ' A' ' 55' ' ' VAL . 30.5 ttp -56.99 -44.68 82.98 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.4 mmt -85.8 -32.54 21.73 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 119.086 -1.046 . . . . 0.0 112.52 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.26 -40.42 97.37 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -66.07 -26.21 67.39 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 121.848 0.832 . . . . 0.0 110.364 178.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -87.28 -28.99 21.97 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 114.626 -1.17 . . . . 0.0 109.389 -176.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.3 ttm . . . . . 0 C--N 1.319 -0.726 0 CA-C-N 114.53 -1.213 . . . . 0.0 111.479 -177.822 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.428 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 2.1 mp0 . . . . . 0 C--O 1.211 -0.952 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 45.0 mt-10 -65.06 -59.56 4.0 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -52.93 -39.75 63.09 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.257 1.027 . . . . 0.0 109.496 176.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.4 mm -67.63 -51.26 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-N 113.376 -1.738 . . . . 0.0 110.354 -173.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.412 ' O ' ' HG2' ' A' ' 90' ' ' ARG . 42.8 ttm105 -71.92 -30.99 65.92 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.338 -178.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 47.6 mt-10 -61.28 -44.77 96.67 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.501 0.667 . . . . 0.0 110.181 174.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.46 -34.17 75.47 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.347 178.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -66.89 -50.32 62.84 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.946 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 9.6 ptm180 -66.43 -19.72 65.87 Favored 'General case' 0 N--CA 1.419 -1.998 0 C-N-CA 123.454 0.702 . . . . 0.0 112.767 -176.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.4 p -83.15 -28.72 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 C-N-CA 118.724 -1.191 . . . . 0.0 111.006 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -83.52 -48.19 10.54 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 177.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -75.87 105.33 6.85 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 175.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.446 ' HZ2' ' HB3' ' A' ' 94' ' ' LYS . 7.9 mtpm? -77.88 -16.98 57.84 Favored 'General case' 0 C--N 1.288 -2.093 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -169.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -115.01 -13.06 11.91 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 120.262 -0.575 . . . . 0.0 111.939 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.83 55.75 5.22 Favored Glycine 0 N--CA 1.437 -1.262 0 N-CA-C 108.327 -1.909 . . . . 0.0 108.327 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -100.69 -18.47 16.51 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.065 0.46 . . . . 0.0 110.44 -174.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.64 11.99 59.99 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.256 -1.137 . . . . 0.0 110.256 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -147.46 130.59 16.4 Favored 'General case' 0 CA--C 1.498 -1.024 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -176.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.4 mt -104.74 132.63 50.99 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 175.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.3 p -109.82 160.09 16.65 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.481 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.84 -46.34 82.35 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -175.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.5 98.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.181 0.515 . . . . 0.0 109.87 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -61.62 -40.13 93.77 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.518 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 4.0 tt -61.56 -43.55 98.65 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.446 ' HG3' HG23 ' A' ' 121' ' ' VAL . 31.0 mtm180 -60.89 -40.49 93.22 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 121.249 -0.181 . . . . 0.0 111.473 174.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -57.24 -50.82 71.68 Favored 'General case' 0 C--O 1.244 0.802 0 O-C-N 123.174 0.297 . . . . 0.0 111.523 178.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.517 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.2 p -68.6 -34.42 65.1 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 C-N-CA 119.819 -0.753 . . . . 0.0 110.06 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 23.3 mmt -65.7 -36.28 83.17 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 58.3 m -63.08 -36.9 85.13 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -69.12 -35.01 75.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.267 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 80.0 mt -87.5 -20.49 26.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -172.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 71.07 32.21 66.05 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 116.335 -0.393 . . . . 0.0 112.279 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -81.14 -25.12 37.13 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -178.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt 69.55 71.92 0.24 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.887 0.875 . . . . 0.0 111.0 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 32.6 mt -118.61 130.58 55.96 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 37.8 p -83.47 174.09 10.92 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.909 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -57.12 -44.16 83.04 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 122.939 0.496 . . . . 0.0 111.013 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -55.57 -44.65 77.08 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 123.765 0.666 . . . . 0.0 111.251 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -69.52 -48.91 58.96 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.824 -175.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.446 HG23 ' HG3' ' A' ' 106' ' ' ARG . 7.3 m -67.88 -34.23 66.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.314 -177.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -69.87 -40.13 75.92 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.229 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.489 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 11.1 tp10 -65.62 -42.14 91.91 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 54.1 mtt -57.3 -50.91 71.43 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.65 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 121' ' ' VAL . 42.8 mm -56.01 -47.16 80.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -63.05 -29.97 71.23 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 123' ' ' GLU . 49.1 mt-10 -70.49 -42.42 71.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.016 0.436 . . . . 0.0 110.296 177.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.41 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -81.55 -33.38 31.74 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.22 -0.446 . . . . 0.0 112.01 -176.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -68.37 107.3 2.8 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 123.894 0.878 . . . . 0.0 109.975 177.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 68.9 mt -82.54 -42.41 18.38 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.752 -177.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -76.02 -11.79 60.01 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.007 0.432 . . . . 0.0 112.046 -174.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 68.84 46.98 58.15 Favored Glycine 0 N--CA 1.44 -1.063 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -99.61 -16.18 18.32 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 121.412 0.625 . . . . 0.0 110.51 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.22 -4.2 58.54 Favored Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.989 -0.624 . . . . 0.0 111.742 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -135.76 142.44 44.96 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -100.28 126.57 53.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 O-C-N 123.595 0.559 . . . . 0.0 111.086 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -85.22 169.02 14.22 Favored 'General case' 0 CA--C 1.501 -0.908 0 O-C-N 123.679 0.612 . . . . 0.0 110.57 177.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.531 ' O ' HG13 ' A' ' 142' ' ' VAL . 92.0 t80 -60.14 -45.46 92.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.302 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.419 ' O ' HG23 ' A' ' 142' ' ' VAL . 4.1 mp0 -62.46 -29.95 70.9 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.695 0.798 . . . . 0.0 111.276 -179.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.41 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 47.4 mt-10 -82.57 -35.71 26.89 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.198 0.523 . . . . 0.0 109.736 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -69.4 -39.36 77.99 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.341 178.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.531 HG13 ' O ' ' A' ' 138' ' ' TYR . 19.5 m -58.58 -34.79 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-O 120.701 0.286 . . . . 0.0 110.524 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.92 -40.86 90.3 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.364 -179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 70.2 mtp -86.38 -36.08 19.41 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 17.2 tpt . . . . . 0 C--N 1.314 -0.943 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.625 -177.098 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? . . . . . 0 N--CA 1.44 -0.936 0 CA-C-O 122.36 1.076 . . . . 0.0 109.14 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' B' ' 83' ' ' GLU . 11.8 mp0 -63.22 -49.01 75.86 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 113.209 -1.814 . . . . 0.0 108.787 178.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.27 -32.53 72.76 Favored 'General case' 0 C--O 1.192 -1.971 0 CA-C-N 115.187 -0.915 . . . . 0.0 112.09 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -64.01 -43.39 95.79 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-N 118.228 0.467 . . . . 0.0 111.74 177.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -62.82 -46.26 88.8 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -60.32 -44.51 95.4 Favored 'General case' 0 C--O 1.205 -1.245 0 CA-C-N 114.078 -1.419 . . . . 0.0 111.873 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.7 -54.41 47.43 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 123.579 0.752 . . . . 0.0 112.149 -178.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 35.3 pt -64.82 -32.21 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 121.289 0.566 . . . . 0.0 111.274 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -69.09 -51.58 37.16 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.336 177.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -67.48 -45.19 76.6 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 123.443 0.697 . . . . 0.0 111.77 -178.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.59 -51.35 70.21 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.089 -176.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt . . . . . 0 C--N 1.318 -0.775 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.065 178.433 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.427 HD21 HG12 ' A' ' 9' ' ' ILE . 12.3 tp . . . . . 0 N--CA 1.422 -1.826 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.1 p -78.2 143.52 37.09 Favored 'General case' 0 N--CA 1.421 -1.896 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.099 179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -55.73 -45.16 78.03 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.348 1.059 . . . . 0.0 112.512 -175.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.5 -41.18 96.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.023 0.44 . . . . 0.0 109.985 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -63.85 -42.51 97.56 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.846 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.432 HG22 ' HE3' ' A' ' 13' ' ' LYS . 65.4 mt -63.55 -37.38 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.991 176.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.68 -41.73 99.25 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.436 177.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -61.58 -44.19 97.48 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.608 175.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -59.53 -48.69 80.69 Favored 'General case' 0 C--O 1.197 -1.658 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.402 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.432 ' HE3' HG22 ' A' ' 9' ' ' ILE . 98.3 mttt -50.09 -43.87 51.72 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 122.966 0.506 . . . . 0.0 111.99 179.661 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.86 -59.44 3.29 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.405 -177.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.83 -33.6 75.09 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -175.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -63.51 -45.2 91.76 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 123.029 0.532 . . . . 0.0 110.029 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.8 m -74.11 -16.43 61.01 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.276 0.56 . . . . 0.0 110.966 178.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -79.13 -54.18 6.25 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.311 176.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -80.48 -20.73 43.04 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -174.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -67.81 101.08 1.01 Allowed 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 171.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 74.5 mmtt -62.3 -7.7 4.71 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 116.083 1.883 . . . . 0.0 116.083 -171.065 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -109.95 -13.82 14.36 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.04 29.78 75.66 Favored Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.105 -176.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -104.34 -17.76 14.69 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.021 -0.671 . . . . 0.0 110.719 -176.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.95 4.16 63.45 Favored Glycine 0 N--CA 1.431 -1.693 0 C-N-CA 119.661 -1.257 . . . . 0.0 115.123 176.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.0 p -124.73 129.76 51.1 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 119.239 1.52 . . . . 0.0 109.582 170.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.9 mt -91.07 126.99 43.75 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.752 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.389 -174.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 p -102.57 167.01 10.2 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.15 173.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.8 p -53.73 -45.54 70.54 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 123.886 0.874 . . . . 0.0 113.005 -178.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -59.61 -34.98 73.45 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.495 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -70.35 -38.48 74.82 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.043 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.97 -47.87 84.46 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 175.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.418 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -64.28 -26.48 70.59 Favored Glycine 0 C--O 1.198 -2.151 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.473 179.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.7 m -68.99 -49.8 54.61 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 117.582 0.691 . . . . 0.0 110.565 179.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 30.4 m -70.62 -29.68 39.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.409 -0.516 . . . . 0.0 111.135 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtt -69.13 -42.86 75.46 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 40.5 ttm180 -56.3 -39.57 72.95 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.344 1.458 . . . . 0.0 109.461 178.011 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 m -65.58 -32.64 74.33 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.141 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 82.6 mt -87.97 -13.73 40.99 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.226 0.536 . . . . 0.0 110.275 178.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.74 47.11 2.36 Favored Glycine 0 N--CA 1.44 -1.064 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.783 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -148.5 130.29 15.13 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 176.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -132.54 82.4 57.03 Favored Pre-proline 0 C--N 1.286 -2.175 0 C-N-CA 120.258 -0.577 . . . . 0.0 112.046 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -70.36 160.87 48.06 Favored 'Trans proline' 0 C--O 1.243 0.771 0 C-N-CA 122.581 2.187 . . . . 0.0 109.657 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.5 t -80.81 157.38 25.75 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.725 -176.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.82 -31.11 62.39 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.078 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.09 -42.66 95.13 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.726 0.298 . . . . 0.0 111.029 176.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 51' ' ' MET . 40.7 mt-10 -66.79 -43.25 84.44 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.459 0.647 . . . . 0.0 109.295 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 66.1 mt -64.31 -38.27 90.46 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.71 -178.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -66.33 -39.07 89.0 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.567 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.41 -38.99 88.69 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.677 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.402 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 24.4 mmt -60.83 -40.38 92.55 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.228 176.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.7 mt -66.19 -47.04 85.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.953 177.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -64.62 -12.61 47.45 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.797 -173.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -61.84 -40.17 94.36 Favored 'General case' 0 N--CA 1.392 -3.367 0 C-N-CA 123.861 0.864 . . . . 0.0 110.428 175.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.501 HG11 ' HB2' ' A' ' 71' ' ' MET . 19.3 m -112.21 -10.94 11.94 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.813 -178.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -73.53 103.23 4.08 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.371 0.605 . . . . 0.0 110.859 -178.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.49 -11.12 49.89 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.023 -0.989 . . . . 0.0 111.693 -177.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -93.32 -11.49 32.29 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 119.869 -0.732 . . . . 0.0 110.566 -176.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 61.44 36.38 92.45 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -115.65 -12.14 11.6 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 122.732 -0.275 . . . . 0.0 110.967 -177.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.11 17.19 32.86 Favored Glycine 0 N--CA 1.434 -1.492 0 N-CA-C 115.373 0.909 . . . . 0.0 115.373 173.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.1 p -132.48 143.14 49.56 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-N 118.39 1.095 . . . . 0.0 111.49 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.9 mt -92.36 112.96 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -84.41 161.29 20.39 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 177.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.44 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 74.7 t80 -55.56 -50.04 89.22 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.685 0.394 . . . . 0.0 111.567 177.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.44 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 4.8 Cg_endo -49.68 -43.85 38.24 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 122.494 2.129 . . . . 0.0 112.671 173.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -71.78 -36.78 70.44 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.475 0.655 . . . . 0.0 110.045 -178.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -61.87 -43.82 98.06 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.751 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.1 mt -61.16 -45.45 94.6 Favored 'General case' 0 C--O 1.208 -1.131 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.269 178.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.5 m -57.12 -40.6 77.4 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 123.601 0.563 . . . . 0.0 110.536 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.501 ' HB2' HG11 ' A' ' 55' ' ' VAL . 27.5 ttp -55.51 -55.84 27.25 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.066 0.947 . . . . 0.0 112.143 -179.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.413 ' SD ' ' HE1' ' A' ' 71' ' ' MET . 1.1 mpt? -79.5 -38.55 34.13 Favored 'General case' 0 C--O 1.196 -1.711 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -179.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.26 -33.87 74.23 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -176.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -83.54 -19.17 36.15 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.896 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -83.07 -48.08 10.98 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . 0.262 1.8 ppp? . . . . . 0 N--CA 1.437 -1.115 0 CA-C-O 122.397 1.094 . . . . 0.0 113.388 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 . . . . . 0 C--O 1.205 -1.273 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.547 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 8.5 mm-40 -41.76 -59.6 1.62 Allowed 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 116.115 1.894 . . . . 0.0 116.115 -168.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -85.38 -24.78 27.41 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.908 0.861 . . . . 0.0 109.619 -175.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.409 HG21 ' HG2' ' A' ' 145' ' ' MET . 6.6 mm -73.46 -40.92 56.48 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.025 0 CA-C-N 114.436 -1.256 . . . . 0.0 108.762 -172.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -73.75 -26.67 60.78 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.855 178.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.547 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 43.1 mt-10 -64.02 -44.16 93.43 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 173.308 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.466 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -66.88 -37.01 83.6 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 114.552 -1.204 . . . . 0.0 110.803 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -72.18 -46.24 57.12 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.634 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.2 mtm180 -69.8 -18.28 63.46 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -177.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.466 HG12 ' O ' ' A' ' 88' ' ' ALA . 9.0 p -75.92 -20.57 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.037 178.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -97.0 -55.12 2.96 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -84.44 79.07 9.69 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.897 1.332 . . . . 0.0 109.367 176.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.452 ' HB2' ' HZ2' ' A' ' 94' ' ' LYS . 8.5 mtmp? -78.59 -18.36 54.71 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 113.289 -1.778 . . . . 0.0 111.482 -176.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -91.33 -12.49 34.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.889 -177.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.83 45.79 49.74 Favored Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -94.86 -14.65 24.37 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.414 0.626 . . . . 0.0 109.967 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.18 8.09 82.22 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.552 177.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -142.95 138.95 30.48 Favored 'General case' 0 CA--C 1.491 -1.327 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -178.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.452 ' HB ' HG11 ' A' ' 136' ' ' VAL . 3.1 mt -97.56 124.98 50.8 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 174.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.6 m -102.02 150.53 23.13 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 123.831 0.707 . . . . 0.0 110.221 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.44 -45.06 81.1 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.74 -41.08 85.64 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 122.63 0.372 . . . . 0.0 110.752 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -59.15 -55.85 29.75 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.137 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.574 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.6 tt -59.93 -40.55 89.3 Favored 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.294 -172.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.404 ' HB2' HG21 ' A' ' 121' ' ' VAL . 0.0 OUTLIER -65.29 -38.87 91.57 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -63.07 -51.02 68.29 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.285 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.54 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -65.87 -31.51 54.06 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.38 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.371 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.574 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.4 mmt -62.55 -37.1 84.82 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 13.8 m -60.68 -46.55 89.92 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 175.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -69.08 -16.73 63.75 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 114.622 -1.172 . . . . 0.0 111.814 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 95.3 mt -100.9 -2.36 32.19 Favored 'General case' 0 C--N 1.316 -0.889 0 O-C-N 121.985 -0.447 . . . . 0.0 111.617 -177.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 81.02 1.24 89.84 Favored Glycine 0 C--O 1.237 0.301 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.466 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.429 ' HG3' ' SD ' ' A' ' 109' ' ' MET . 20.4 mm-40 -70.9 -48.69 52.32 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 52.08 73.47 0.32 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 124.519 1.137 . . . . 0.0 110.665 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.1 mt -97.5 157.64 15.9 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.166 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.4 p -76.82 158.64 30.7 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.497 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -67.84 -23.09 65.12 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-O 121.112 0.482 . . . . 0.0 109.892 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.81 -42.83 63.44 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 123.158 0.583 . . . . 0.0 110.375 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -68.22 -44.5 75.6 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.335 0.588 . . . . 0.0 109.863 -176.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.404 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.4 m -69.07 -29.58 43.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.143 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.84 -41.15 92.11 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.8 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -63.85 -43.51 95.94 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 55.4 mtt -53.89 -34.8 60.53 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.413 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.413 ' CG2' ' HA ' ' A' ' 135' ' ' GLN . 51.3 mm -86.23 -58.52 3.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.46 179.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.62 -38.35 86.75 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -171.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -70.15 -28.65 65.52 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.426 ' HA ' ' SD ' ' A' ' 144' ' ' MET . . . -80.18 -35.76 35.97 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.221 179.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.67 85.56 0.65 Allowed 'General case' 0 C--N 1.307 -1.276 0 CA-C-O 122.582 1.182 . . . . 0.0 112.424 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 28.9 mt -83.44 -8.74 11.41 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 CA-C-N 114.078 -1.419 . . . . 0.0 109.106 174.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.414 ' HB2' ' OE2' ' A' ' 140' ' ' GLU . 31.8 t70 -90.15 -12.47 38.11 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.607 -172.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.79 35.68 58.41 Favored Glycine 0 N--CA 1.433 -1.551 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.611 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -100.35 -16.87 17.5 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.444 0.64 . . . . 0.0 109.772 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.95 -2.28 85.53 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -176.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.413 ' HA ' ' CG2' ' A' ' 125' ' ' ILE . 21.9 mt-30 -138.37 147.29 43.27 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.634 1.173 . . . . 0.0 108.803 -178.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.452 HG11 ' HB ' ' A' ' 100' ' ' ILE . 1.4 p -86.69 121.11 37.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 C-N-CA 119.811 -0.756 . . . . 0.0 110.879 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -91.54 177.07 6.32 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.987 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -70.05 -41.6 73.98 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.984 -173.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -63.94 -42.13 97.43 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.095 0.474 . . . . 0.0 111.408 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.414 ' OE2' ' HB2' ' A' ' 131' ' ' ASP . 0.5 OUTLIER -70.48 -30.66 67.51 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.835 177.347 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -70.75 -45.37 64.94 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.054 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.9 m -62.45 -33.91 61.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-O 120.927 0.394 . . . . 0.0 110.828 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -60.9 -46.41 90.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.966 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.426 ' SD ' ' HA ' ' A' ' 128' ' ' ALA . 40.1 mtm -75.23 -40.17 59.29 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.693 -178.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.409 ' HG2' HG21 ' A' ' 85' ' ' ILE . 10.0 tpt . . . . . 0 C--N 1.32 -0.701 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.508 -175.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt . . . . . 0 C--O 1.247 0.947 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -80.26 -44.06 20.29 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.099 0.476 . . . . 0.0 110.147 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.84 -37.16 83.43 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.055 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.452 ' O ' HG13 ' B' ' 89' ' ' ILE . 48.2 m95 -57.56 -45.66 84.87 Favored 'General case' 0 C--O 1.206 -1.235 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 176.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -55.56 -49.51 72.48 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 122.512 1.149 . . . . 0.0 109.811 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -66.41 -36.6 83.25 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 113.149 -1.841 . . . . 0.0 111.195 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -77.44 -41.28 40.36 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.452 HG13 ' O ' ' B' ' 85' ' ' TRP . 83.1 mt -57.85 -50.99 75.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 122.943 0.497 . . . . 0.0 111.886 -178.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -68.18 -31.39 70.9 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.615 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -65.99 -46.29 78.53 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.839 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.69 92.63 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.265 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 96.6 mttt . . . . . 0 N--CA 1.466 0.359 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.299 178.863 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.3 tp . . . . . 0 N--CA 1.442 -0.828 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.0 p -82.32 145.36 29.99 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -176.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -51.08 -50.59 58.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.812 1.245 . . . . 0.0 113.371 -176.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -66.72 -34.96 79.01 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.257 0.551 . . . . 0.0 110.705 -177.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.589 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 52.0 tp60 -74.36 -36.33 63.59 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.307 -178.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.55 -40.67 85.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.939 176.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.93 -38.81 92.5 Favored 'General case' 0 C--O 1.255 1.376 0 CA-C-O 121.334 0.588 . . . . 0.0 110.647 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.423 ' CD ' ' HZ2' ' B' ' 86' ' ' LYS . 35.7 tt0 -62.88 -45.51 92.19 Favored 'General case' 0 C--O 1.249 1.059 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.255 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.589 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 23.1 m-85 -60.45 -38.75 85.17 Favored 'General case' 0 C--O 1.197 -1.667 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.837 178.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.437 ' HG2' ' CZ ' ' A' ' 65' ' ' PHE . 98.9 mttt -55.17 -51.12 67.51 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 121.026 0.441 . . . . 0.0 111.304 177.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -68.04 -46.85 69.99 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.291 -178.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.598 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -70.52 -21.87 62.69 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.995 -176.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -67.51 -53.56 27.54 Favored 'General case' 0 CA--C 1.486 -1.513 0 C-N-CA 123.41 0.684 . . . . 0.0 109.408 174.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 t -67.4 -16.82 64.45 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 121.018 0.437 . . . . 0.0 110.359 -177.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.598 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 16.7 tp -59.35 -46.84 87.52 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.56 172.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.424 ' HB2' HG13 ' A' ' 35' ' ' VAL . 25.2 p90 -101.42 -25.79 13.81 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.985 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -75.98 99.15 4.47 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 174.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -48.96 -34.52 13.11 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 116.767 2.136 . . . . 0.0 116.767 -170.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.1 p30 -110.47 -13.11 14.31 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 27.58 73.66 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.813 -0.232 . . . . 0.0 112.851 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -81.65 -16.48 51.26 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.165 0.507 . . . . 0.0 110.952 -176.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.43 0.26 46.83 Favored Glycine 0 N--CA 1.434 -1.442 0 C-N-CA 120.657 -0.783 . . . . 0.0 114.252 -178.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.2 p -128.89 129.4 45.48 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 118.898 1.349 . . . . 0.0 109.955 173.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.6 mt -89.38 111.97 23.68 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 179.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.6 p -87.74 170.04 11.58 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.993 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.3 p -63.02 -33.57 75.71 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 123.019 0.2 . . . . 0.0 110.852 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -52.61 -54.82 27.92 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.253 174.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.75 -45.04 79.86 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.188 -174.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 71.5 mt -60.17 -45.68 92.28 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 178.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.98 -29.04 67.52 Favored Glycine 0 C--O 1.207 -1.532 0 C-N-CA 118.997 -1.573 . . . . 0.0 112.188 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.8 m -69.57 -44.12 71.47 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 117.255 0.528 . . . . 0.0 110.436 177.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.424 HG13 ' HB2' ' A' ' 19' ' ' PHE . 25.1 m -66.76 -36.21 76.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-O 121.149 0.499 . . . . 0.0 109.949 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.516 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 63.2 mtt -68.46 -42.51 78.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.607 176.063 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.407 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 68.5 ttt180 -62.85 -25.59 68.35 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 123.873 0.869 . . . . 0.0 110.819 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.0 m -63.09 -30.25 71.45 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.349 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -98.05 9.34 43.07 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 120.9 0.381 . . . . 0.0 111.077 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.42 -9.7 75.54 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.767 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.407 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 62.1 tt0 -71.8 118.36 14.55 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -113.41 84.43 7.7 Favored Pre-proline 0 C--N 1.289 -2.052 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 177.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.516 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 73.1 Cg_endo -89.65 162.33 5.25 Favored 'Trans proline' 0 N--CA 1.434 -2.015 0 C-N-CA 122.409 2.072 . . . . 0.0 111.237 177.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.2 p -89.13 167.53 13.05 Favored 'General case' 0 C--N 1.283 -2.297 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 175.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -64.84 -30.21 71.2 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.54 89.35 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.708 0.289 . . . . 0.0 110.834 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -66.8 -38.47 86.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.535 0.683 . . . . 0.0 110.584 179.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.1 mt -68.67 -44.8 73.27 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.149 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -63.49 -34.88 78.75 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.718 -1.128 . . . . 0.0 109.847 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.22 -43.19 98.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.707 177.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 14.6 tpt -69.06 -36.31 77.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.373 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 67.8 mt -63.31 -55.76 21.22 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.367 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.43 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -57.9 -31.8 67.12 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 123.411 0.684 . . . . 0.0 112.007 -175.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.47 -31.88 66.39 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 123.955 0.902 . . . . 0.0 110.048 178.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.639 HG13 ' SD ' ' A' ' 71' ' ' MET . 32.9 m -114.89 -11.4 12.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 O-C-N 121.825 -0.547 . . . . 0.0 112.12 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -76.26 114.55 15.06 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 -174.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.85 -10.39 53.54 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.191 -178.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -106.99 -12.37 15.45 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.717 -176.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.78 44.8 94.05 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -175.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -115.37 0.83 13.56 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -174.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.02 23.6 37.67 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.191 -1.004 . . . . 0.0 113.86 173.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.7 p -150.73 142.05 23.3 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 116.981 0.391 . . . . 0.0 111.364 179.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.3 mt -97.97 104.19 15.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 175.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.537 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 6.7 t70 -78.84 164.81 24.18 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 -178.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.437 ' CZ ' ' HG2' ' A' ' 13' ' ' LYS . 61.3 t80 -52.68 -50.39 81.06 Favored Pre-proline 0 CA--C 1.554 1.112 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.537 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 4.8 Cg_endo -49.81 -49.6 15.51 Favored 'Trans proline' 0 C--N 1.364 1.375 0 C-N-CA 122.735 2.29 . . . . 0.0 112.019 172.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -63.05 -37.98 89.37 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.268 0.556 . . . . 0.0 109.753 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.406 ' O ' ' HG2' ' A' ' 72' ' ' MET . 39.7 t80 -64.33 -39.34 93.7 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.417 178.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.9 mt -66.55 -42.49 87.05 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.6 m -57.53 -45.29 85.2 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.639 ' SD ' HG13 ' A' ' 55' ' ' VAL . 42.6 ttp -64.94 -37.96 89.38 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.493 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.464 ' HA ' ' HE1' ' A' ' 72' ' ' MET . 28.7 mmt -63.91 -43.3 96.36 Favored 'General case' 0 C--N 1.321 -0.674 0 O-C-N 122.259 -0.276 . . . . 0.0 110.863 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.97 -35.05 79.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.063 0.459 . . . . 0.0 109.895 176.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -69.88 -23.73 63.3 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.327 1.051 . . . . 0.0 110.749 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.476 ' HD3' ' O ' ' A' ' 71' ' ' MET . 4.1 mptp? -81.03 -20.41 41.76 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 121.888 -0.508 . . . . 0.0 111.377 177.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 21.5 ptp . . . . . 0 C--N 1.324 -0.521 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -171.871 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -58.29 -50.27 74.21 Favored 'General case' 0 C--O 1.205 -1.272 0 C-N-CA 123.4 0.68 . . . . 0.0 109.448 -178.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -64.96 -29.29 70.21 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -178.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 30.0 mm -71.67 -47.28 58.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.0 ttm-85 -70.39 -30.08 66.89 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.87 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.47 -47.4 79.29 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.965 0.906 . . . . 0.0 112.162 174.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.48 94.86 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.091 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.18 -45.55 87.89 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-O 121.351 0.596 . . . . 0.0 109.51 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -56.34 -41.79 76.65 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 126.571 1.948 . . . . 0.0 111.987 -179.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.1 p -73.39 -27.06 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.118 -177.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -84.33 -60.06 2.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.647 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -79.59 81.86 5.79 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 121.981 0.896 . . . . 0.0 110.833 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -79.1 -38.43 36.24 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.493 -1.231 . . . . 0.0 111.987 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -73.55 -13.87 61.1 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 121.28 0.562 . . . . 0.0 111.036 -176.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.41 60.25 4.15 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.993 175.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 37.5 m-80 -99.33 -10.29 22.49 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.03 0.443 . . . . 0.0 110.755 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.82 1.88 84.73 Favored Glycine 0 CA--C 1.498 -0.982 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -153.5 150.13 28.43 Favored 'General case' 0 N--CA 1.412 -2.356 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.487 ' HB ' HG11 ' A' ' 136' ' ' VAL . 5.4 mt -98.55 124.36 51.66 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.114 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.1 m -101.59 159.04 15.64 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.08 -42.12 89.67 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.16 -44.3 89.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.295 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.609 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 3.1 tp10 -59.11 -46.76 87.48 Favored 'General case' 0 CA--C 1.494 -1.184 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.898 176.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.532 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.7 tt -62.3 -36.63 82.72 Favored 'General case' 0 N--CA 1.418 -2.039 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -174.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.2 -32.53 71.88 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . 0.609 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 48.0 m170 -53.49 -55.61 23.91 Favored 'General case' 0 C--O 1.26 1.658 0 CA-C-O 121.478 0.656 . . . . 0.0 110.117 177.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.413 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.7 p -65.79 -34.68 71.94 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.06 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.538 -178.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.532 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 19.8 mmt -62.13 -43.11 99.56 Favored 'General case' 0 CA--C 1.491 -1.324 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 m -59.43 -37.78 78.95 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.033 177.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -79.02 -22.91 44.75 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.2 177.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 93.0 mt -84.96 -20.0 31.27 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.778 0.323 . . . . 0.0 110.81 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 103.0 2.67 48.85 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.569 178.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -85.3 115.73 23.23 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.326 0.584 . . . . 0.0 111.279 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -85.8 76.13 9.95 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.411 HD12 ' HG3' ' A' ' 109' ' ' MET . 66.2 mt -101.14 147.54 26.13 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.011 -177.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.9 p -83.86 165.76 18.49 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.144 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -64.78 -39.28 93.35 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -54.5 -49.71 69.52 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.169 176.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -59.4 -54.5 45.95 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.902 -176.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 125' ' ' ILE . 18.3 m -65.78 -35.79 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.378 -175.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.573 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 11.3 t70 -66.85 -42.06 86.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.357 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -69.92 -29.15 66.25 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.172 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 66.3 mtt -58.89 -49.66 76.95 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 173.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.9 mm -53.37 -46.44 58.07 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.603 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.661 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.573 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 27.5 mmt180 -62.07 -32.34 72.86 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -175.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -79.38 -35.89 40.09 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 120.1 -0.64 . . . . 0.0 111.241 178.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.419 ' HA ' ' HG2' ' A' ' 144' ' ' MET . . . -79.81 -21.36 44.36 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 121.706 0.765 . . . . 0.0 110.467 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -82.5 88.39 6.63 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.408 173.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 61.4 mt -81.85 -42.62 19.29 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -75.8 -9.29 58.47 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.8 53.84 3.86 Favored Glycine 0 N--CA 1.438 -1.213 0 C-N-CA 120.545 -0.836 . . . . 0.0 111.813 175.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -105.38 -10.35 17.03 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 90.72 -8.81 79.25 Favored Glycine 0 CA--C 1.499 -0.941 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.115 176.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -141.35 138.3 32.97 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.487 HG11 ' HB ' ' A' ' 100' ' ' ILE . 0.8 OUTLIER -81.78 114.67 23.06 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 N-CA-C 113.159 0.799 . . . . 0.0 113.159 -175.446 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -90.66 163.62 14.46 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.749 ' O ' HG21 ' A' ' 142' ' ' VAL . 47.4 t80 -55.5 -59.92 4.15 Favored 'General case' 0 C--O 1.198 -1.62 0 CA-C-O 117.96 -1.019 . . . . 0.0 113.165 -174.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -53.71 -37.15 62.99 Favored 'General case' 0 CA--C 1.561 1.399 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -172.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -73.95 -35.07 64.52 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 120.121 -0.631 . . . . 0.0 110.44 178.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -66.51 -41.74 88.4 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.182 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.749 HG21 ' O ' ' A' ' 138' ' ' TYR . 6.3 t -52.6 -43.03 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.424 0 C-N-CA 124.47 1.108 . . . . 0.0 109.841 177.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -66.82 -55.92 12.7 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.92 -178.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.419 ' HG2' ' HA ' ' A' ' 128' ' ' ALA . 3.1 ppp? -76.47 -20.45 56.99 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -174.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 C--O 1.242 0.689 0 CA-C-O 120.971 0.415 . . . . 0.0 110.117 175.537 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . 0.57 ' O ' ' HG3' ' B' ' 86' ' ' LYS . 13.0 mptt . . . . . 0 C--O 1.214 -0.798 0 CA-C-O 119.811 -0.138 . . . . 0.0 111.295 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.47 -36.97 85.9 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 174.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.47 -46.21 80.68 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.508 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -61.65 -24.91 67.04 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . 0.619 ' HG2' ' OE1' ' B' ' 90' ' ' GLN . 67.1 mttm -68.79 -31.42 70.42 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.163 0.506 . . . . 0.0 110.549 175.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . 0.548 ' O ' ' HB3' ' B' ' 91' ' ' LYS . 74.8 m80 -84.07 -29.7 26.62 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.555 177.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -86.4 -63.15 1.36 Allowed 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -177.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 64.7 mt -81.57 -58.39 3.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 O-C-N 122.198 -0.314 . . . . 0.0 111.085 -173.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . 0.619 ' OE1' ' HG2' ' B' ' 86' ' ' LYS . 46.3 mt-30 -59.1 -36.06 74.5 Favored 'General case' 0 C--O 1.202 -1.421 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.163 -178.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . 0.548 ' HB3' ' O ' ' B' ' 87' ' ' HIS . 20.3 tptp -80.67 -33.31 35.61 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.13 -46.44 77.51 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.571 0.7 . . . . 0.0 110.744 179.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.2 mmmt . . . . . 0 C--O 1.196 -1.727 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.937 -177.64 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.1 tp . . . . . 0 N--CA 1.425 -1.691 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.9 p -74.68 142.84 44.44 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -67.25 -30.25 70.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -171.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -63.43 -40.09 96.24 Favored 'General case' 0 C--O 1.245 0.859 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 177.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.424 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 6.6 tp-100 -72.95 -36.32 67.15 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.376 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.459 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 64.7 mt -61.64 -37.84 78.88 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.945 176.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.1 -43.12 99.36 Favored 'General case' 0 C--O 1.256 1.408 0 CA-C-O 121.646 0.736 . . . . 0.0 110.371 176.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -60.62 -41.24 94.46 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.611 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.424 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 21.3 m-85 -74.96 -12.0 60.24 Favored 'General case' 0 C--O 1.189 -2.125 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 177.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 67.7 mttm -69.58 -48.81 58.92 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 173.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.72 -39.91 88.18 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 119.699 -0.8 . . . . 0.0 110.084 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.56 -24.14 63.66 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.409 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.577 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 70.1 t80 -68.52 -52.34 33.12 Favored 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 176.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 m -69.55 -16.69 63.47 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.15 -178.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.78 -31.86 72.91 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 173.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.526 ' CD2' HG23 ' A' ' 35' ' ' VAL . 8.8 m-85 -98.29 -43.13 7.08 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.771 177.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -79.43 87.44 5.06 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 122.143 0.973 . . . . 0.0 109.222 176.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 27.5 mmmt -71.27 -26.22 62.8 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 114.046 -1.434 . . . . 0.0 112.358 -172.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.602 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 1.5 m-20 -90.98 -13.17 33.88 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.754 -177.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.46 58.41 9.46 Favored Glycine 0 C--O 1.223 -0.564 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.404 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.602 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 10.3 m-20 -112.12 -16.74 12.97 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -176.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.31 11.4 58.48 Favored Glycine 0 C--N 1.313 -0.722 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 -173.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.2 p -144.7 136.83 26.09 Favored 'General case' 0 N--CA 1.441 -0.925 0 C-N-CA 123.369 0.668 . . . . 0.0 110.167 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 56.9 mt -104.87 127.92 59.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 p -103.18 172.91 6.55 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.922 177.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.3 p -64.34 -27.98 69.4 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.881 0.372 . . . . 0.0 111.182 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -53.18 -54.01 42.12 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 124.553 1.141 . . . . 0.0 109.392 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.508 ' HB3' ' O ' ' A' ' 19' ' ' PHE . 35.1 mt-10 -71.2 -38.81 72.05 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 113.719 -1.582 . . . . 0.0 111.271 -174.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -59.32 -49.39 78.0 Favored 'General case' 0 C--O 1.208 -1.112 0 O-C-N 123.447 0.467 . . . . 0.0 110.907 176.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.13 -27.67 72.61 Favored Glycine 0 C--O 1.222 -0.613 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.465 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.2 m -65.7 -50.08 66.18 Favored 'General case' 0 C--O 1.262 1.739 0 CA-C-O 121.693 0.759 . . . . 0.0 109.591 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.689 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 34.8 m -73.35 -41.08 57.3 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.194 -178.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -48.12 75.61 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 123.166 0.587 . . . . 0.0 110.948 177.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -58.26 -39.56 79.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.943 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.8 m -68.63 -27.32 65.91 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 121.328 0.585 . . . . 0.0 111.164 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 52.3 mt -84.1 -20.27 32.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.324 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.22 19.02 40.43 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -106.07 120.56 42.1 Favored 'General case' 0 N--CA 1.428 -1.573 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -126.11 69.23 66.34 Favored Pre-proline 0 C--N 1.301 -1.539 0 C-N-CA 118.663 -1.215 . . . . 0.0 112.866 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -77.25 163.12 30.63 Favored 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 122.293 1.995 . . . . 0.0 109.875 175.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.411 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 22.8 p -75.29 161.77 29.01 Favored 'General case' 0 C--N 1.295 -1.804 0 CA-C-O 120.46 0.172 . . . . 0.0 111.163 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -57.39 -36.1 70.85 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 177.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.17 -49.69 76.13 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.464 178.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.411 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 8.1 mm-40 -64.22 -42.59 96.52 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.755 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.34 -45.72 89.92 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.557 0.535 . . . . 0.0 111.48 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.4 tm0? -66.63 -40.12 88.6 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -62.46 -38.06 88.36 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.978 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 21.7 mmt -58.49 -40.07 81.78 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.21 175.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.9 mt -67.28 -56.54 13.13 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.15 176.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -57.34 -26.2 60.61 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.488 0.715 . . . . 0.0 112.554 -173.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.57 -46.11 89.83 Favored 'General case' 0 N--CA 1.427 -1.621 0 C-N-CA 123.113 0.565 . . . . 0.0 109.503 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.589 HG12 ' SD ' ' A' ' 71' ' ' MET . 35.3 m -93.71 -19.77 6.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.274 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -67.89 106.84 2.43 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.184 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.55 -9.71 53.65 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.582 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -101.71 -12.56 18.28 Favored 'General case' 0 CA--C 1.497 -1.088 0 C-N-CA 119.263 -0.975 . . . . 0.0 110.284 -173.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 61.23 39.09 96.7 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -172.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -108.14 -2.23 19.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.867 0.365 . . . . 0.0 110.963 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.52 9.14 82.07 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 121.088 -0.577 . . . . 0.0 114.308 172.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 26.2 p -134.88 150.94 50.52 Favored 'General case' 0 C--O 1.256 1.416 0 CA-C-N 117.5 0.65 . . . . 0.0 111.58 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 45.8 mt -91.88 106.64 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 176.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -77.16 163.86 26.19 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.416 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 48.5 t80 -52.01 -53.83 47.47 Favored Pre-proline 0 CA--C 1.561 1.377 0 O-C-N 123.681 0.613 . . . . 0.0 112.33 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.408 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.3 Cg_endo -52.44 -38.49 74.16 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.988 2.459 . . . . 0.0 113.341 176.043 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -71.2 -43.37 67.53 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 121.243 0.544 . . . . 0.0 110.142 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.577 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 56.5 t80 -62.57 -41.77 99.14 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.455 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 91.4 mt -63.17 -49.49 74.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.749 177.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.7 m -57.75 -46.94 83.8 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.589 ' SD ' HG12 ' A' ' 55' ' ' VAL . 16.6 ptt? -67.72 -32.07 72.45 Favored 'General case' 0 CA--C 1.507 -0.692 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.374 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.1 tpp -71.22 -37.27 72.05 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.73 -30.11 71.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.613 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -75.41 -28.69 59.52 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.019 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.478 ' HG3' ' O ' ' A' ' 71' ' ' MET . 94.4 mttt -69.85 -29.75 67.07 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.062 -179.226 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 4.8 mpp? . . . . . 0 N--CA 1.448 -0.528 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 166.369 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 C--O 1.234 0.273 0 CA-C-O 121.182 0.515 . . . . 0.0 111.614 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -66.53 -46.32 76.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.681 -175.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -59.39 -43.68 92.91 Favored 'General case' 0 CA--C 1.501 -0.928 0 O-C-N 124.119 0.887 . . . . 0.0 110.666 -176.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.648 ' HA ' ' SD ' ' A' ' 145' ' ' MET . 7.0 mm -63.95 -49.64 80.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.574 -1.193 . . . . 0.0 109.302 -174.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -69.21 -33.43 73.31 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.969 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -63.74 -53.28 53.52 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.16 -46.01 91.13 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.787 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -60.44 -48.14 83.05 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.096 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.594 ' HA ' ' NE ' ' A' ' 90' ' ' ARG . 0.8 OUTLIER -60.23 -36.66 78.22 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.187 -178.169 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.7 p -75.89 -26.01 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 120.516 -0.474 . . . . 0.0 111.602 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -80.88 -56.32 4.2 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 176.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -88.9 86.15 6.89 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 122.009 0.909 . . . . 0.0 109.201 178.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -78.02 -21.6 50.51 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.249 -174.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.536 ' HB3' ' ND2' ' A' ' 97' ' ' ASN . 13.3 t70 -83.52 -15.13 50.56 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -177.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.501 ' HA2' ' NH2' ' A' ' 90' ' ' ARG . . . 72.06 51.18 14.98 Favored Glycine 0 N--CA 1.44 -1.057 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.804 179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.536 ' ND2' ' HB3' ' A' ' 95' ' ' ASP . 39.6 m-80 -84.1 -19.61 33.96 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.832 0.348 . . . . 0.0 110.168 -178.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.68 -2.91 86.71 Favored Glycine 0 C--O 1.227 -0.319 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.438 ' CE1' ' HB2' ' A' ' 137' ' ' ASN . 91.9 m-85 -143.47 150.11 38.51 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.2 mt -111.36 133.16 57.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 177.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.2 m -98.7 156.96 16.57 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.69 -49.48 62.52 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -173.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.26 -33.75 76.73 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 36.3 tt0 -64.96 -46.97 79.33 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.469 176.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.445 ' O ' HG12 ' A' ' 108' ' ' VAL . 9.1 tt -65.31 -36.51 84.29 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.441 ' HA ' HG13 ' A' ' 121' ' ' VAL . 26.1 ttp180 -62.38 -38.44 89.6 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.322 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . 0.427 ' HB2' ' O ' ' A' ' 104' ' ' GLU . 44.0 m170 -61.62 -54.2 46.02 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.067 176.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 105' ' ' LEU . 6.3 p -61.98 -36.36 73.59 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.55 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.659 -178.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.433 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.3 mmt -64.28 -41.41 96.92 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-O 121.011 0.434 . . . . 0.0 111.08 178.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.2 m -66.07 -33.88 76.79 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 178.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -75.1 -25.17 58.31 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.539 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.4 mt -87.93 -20.36 26.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.333 0.587 . . . . 0.0 110.721 -178.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.39 -14.06 43.29 Favored Glycine 0 C--N 1.305 -1.149 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.898 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.476 ' CD ' ' HZ3' ' B' ' 91' ' ' LYS . 1.1 mp0 -61.85 -42.57 99.21 Favored 'General case' 0 CA--C 1.504 -0.825 0 C-N-CA 123.043 0.537 . . . . 0.0 110.053 177.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 54.5 35.83 24.28 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.454 1.096 . . . . 0.0 111.314 176.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.5 mt -57.95 143.31 43.41 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.246 -177.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 16.7 p -70.21 168.39 15.86 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 123.599 0.562 . . . . 0.0 110.539 178.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -62.81 -35.39 79.76 Favored 'General case' 0 C--O 1.215 -0.735 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -177.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -53.33 -54.58 34.44 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.546 1.138 . . . . 0.0 111.024 176.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -71.69 -38.37 70.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.118 -175.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.441 HG13 ' HA ' ' A' ' 106' ' ' ARG . 11.9 m -70.95 -33.94 53.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.891 -178.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -71.97 -36.36 69.79 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -60.96 -46.37 90.99 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 175.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.425 ' SD ' HD23 ' A' ' 105' ' ' LEU . 35.5 mtt -53.53 -50.45 65.45 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.735 175.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.41 HG12 ' O ' ' A' ' 121' ' ' VAL . 47.3 mm -63.2 -57.2 12.99 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.506 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.557 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -54.95 -42.23 72.07 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -171.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -74.67 -30.77 61.7 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 179.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -84.0 -27.28 28.53 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.339 0.59 . . . . 0.0 110.502 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.445 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 7.7 t70 -67.66 96.17 0.53 Allowed 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 125.626 1.57 . . . . 0.0 109.419 175.123 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.1 mt -82.68 -48.49 17.88 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.836 -176.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.86 -11.3 60.88 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 121.137 0.494 . . . . 0.0 112.245 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.445 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 72.9 47.06 26.78 Favored Glycine 0 C--N 1.306 -1.105 0 N-CA-C 110.814 -0.914 . . . . 0.0 110.814 178.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -98.73 -16.41 18.98 Favored 'General case' 0 C--N 1.306 -1.309 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -178.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.1 10.39 61.15 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -147.77 134.17 19.64 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 124.729 1.212 . . . . 0.0 107.92 -176.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.417 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 0.7 OUTLIER -88.02 121.56 38.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 CA-C-O 120.564 0.221 . . . . 0.0 111.392 -179.491 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.438 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 20.5 t30 -85.77 154.47 21.58 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.304 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.535 ' O ' HG11 ' A' ' 142' ' ' VAL . 42.1 t80 -56.01 -47.55 77.57 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.336 1.054 . . . . 0.0 110.407 178.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.55 -21.62 66.74 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.696 -178.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -87.97 -42.9 12.15 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 122.027 0.917 . . . . 0.0 108.734 177.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -65.9 -28.26 68.81 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.1 -177.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.535 HG11 ' O ' ' A' ' 138' ' ' TYR . 34.6 m -60.34 -29.15 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-O 121.085 0.469 . . . . 0.0 111.638 177.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -79.93 -44.97 19.38 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-O 121.578 0.704 . . . . 0.0 109.586 178.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 90.9 mmm -66.6 -44.22 82.69 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 114.866 -1.061 . . . . 0.0 112.653 -176.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.648 ' SD ' ' HA ' ' A' ' 85' ' ' ILE . 28.3 ttt . . . . . 0 C--N 1.317 -0.848 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -177.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 22.4 tptm . . . . . 0 N--CA 1.448 -0.546 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -60.99 -40.52 93.8 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.598 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.61 -49.75 69.86 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.801 -179.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.4 ' O ' HG12 ' B' ' 89' ' ' ILE . 64.8 m95 -59.71 -39.74 85.63 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.92 177.201 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -53.63 -59.78 4.16 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 122.004 0.907 . . . . 0.0 109.262 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -62.37 -38.0 87.87 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.158 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.08 -51.8 66.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.448 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 85' ' ' TRP . 26.9 pt -66.12 -34.24 68.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.736 -0.386 . . . . 0.0 111.789 -177.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -59.33 -43.89 92.67 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.139 0.495 . . . . 0.0 110.285 175.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . 0.476 ' HZ3' ' CD ' ' A' ' 114' ' ' GLU . 5.6 tppp? -75.02 -45.44 41.74 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.312 -178.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.13 -41.62 97.14 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -174.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp . . . . . 0 N--CA 1.474 0.768 0 CA-C-O 121.282 0.563 . . . . 0.0 110.389 178.541 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.429 HD22 HG12 ' A' ' 9' ' ' ILE . 6.0 tp . . . . . 0 N--CA 1.429 -1.52 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 16.7 p -74.64 154.18 38.62 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.439 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 1.7 mp0 -53.33 -45.23 68.99 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.546 0.738 . . . . 0.0 111.331 -175.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -66.3 -34.32 77.73 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.059 0.457 . . . . 0.0 110.685 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.416 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 8.8 tp-100 -72.23 -36.17 69.05 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.482 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 62.7 mt -66.64 -34.59 71.07 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.852 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.667 175.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.61 98.91 Favored 'General case' 0 C--O 1.267 2.016 0 C-N-CA 123.128 0.571 . . . . 0.0 110.587 174.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 8' ' ' GLN . 42.6 mm-40 -55.64 -49.06 73.87 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 174.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -68.63 -25.9 65.07 Favored 'General case' 0 C--O 1.187 -2.224 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.311 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 32.9 mmtp -56.48 -56.89 15.59 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 175.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -71.15 -40.77 71.16 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.786 -177.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.13 -30.96 71.93 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.323 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -68.08 -44.48 76.19 Favored 'General case' 0 C--O 1.204 -1.315 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.6 m -63.35 -25.68 68.41 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 120.969 0.414 . . . . 0.0 111.509 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -67.17 -36.99 82.98 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.467 ' CD2' HG21 ' A' ' 35' ' ' VAL . 26.0 m-85 -88.17 -38.41 15.34 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.573 -179.048 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -78.2 99.39 6.21 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 176.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -77.93 -5.23 50.42 Favored 'General case' 0 C--N 1.287 -2.143 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.069 -173.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.63 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 4.1 m-20 -116.98 -13.72 10.63 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.51 53.98 25.49 Favored Glycine 0 CA--C 1.524 0.618 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.881 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.63 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 3.6 m-20 -110.66 -17.79 13.31 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 117.233 0.516 . . . . 0.0 110.241 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.38 21.08 39.09 Favored Glycine 0 N--CA 1.439 -1.165 0 N-CA-C 109.299 -1.521 . . . . 0.0 109.299 -173.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.3 p -146.7 130.98 17.49 Favored 'General case' 0 C--O 1.252 1.229 0 C-N-CA 123.87 0.868 . . . . 0.0 109.613 -178.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 75.1 mt -113.35 121.46 65.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.531 ' OG1' ' HB3' ' A' ' 30' ' ' LYS . 17.9 p -93.83 175.51 6.7 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.282 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.3 p -66.78 -26.58 67.03 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-O 121.316 0.579 . . . . 0.0 109.687 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.531 ' HB3' ' OG1' ' A' ' 28' ' ' THR . 35.4 tttm -49.56 -59.31 3.89 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.401 1.48 . . . . 0.0 109.107 171.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -71.61 -35.77 70.58 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.387 -174.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.5 mt -58.21 -52.04 67.23 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.58 0.55 . . . . 0.0 109.753 175.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.85 -30.13 76.52 Favored Glycine 0 C--O 1.216 -1.0 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.243 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.4 m -59.74 -53.37 58.75 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-O 120.897 0.38 . . . . 0.0 110.624 177.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.473 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 34.2 m -70.28 -34.32 58.02 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.369 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.93 -178.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.456 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 49.6 mtt -68.92 -34.94 76.2 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.969 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.0 ttp85 -60.31 -41.9 94.43 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -64.79 -32.3 73.93 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.741 176.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 90.4 mt -84.36 -5.43 59.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.422 -178.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.15 25.46 37.04 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 116.391 -0.368 . . . . 0.0 113.508 178.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -125.59 133.94 52.1 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.65 83.65 35.61 Favored Pre-proline 0 C--N 1.301 -1.507 0 O-C-N 122.226 -0.297 . . . . 0.0 110.513 176.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.456 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 6.1 Cg_exo -82.64 154.34 15.62 Favored 'Trans proline' 0 C--O 1.24 0.616 0 C-N-CA 123.121 2.547 . . . . 0.0 111.251 176.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.9 p -86.19 161.74 18.68 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -46.92 -58.96 3.42 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.894 1.678 . . . . 0.0 112.361 -175.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.49 -29.86 70.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 51' ' ' MET . 8.1 mm-40 -68.94 -45.29 71.14 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.404 ' O ' HG13 ' A' ' 52' ' ' ILE . 79.1 mt -62.8 -41.2 99.17 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.616 -1.175 . . . . 0.0 109.323 177.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -56.1 -48.09 76.81 Favored 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 123.504 0.722 . . . . 0.0 111.269 176.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -63.66 -37.44 87.36 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 120.613 0.244 . . . . 0.0 111.016 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.494 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 28.1 mmt -59.59 -48.1 83.0 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 48' ' ' LEU . 61.1 mt -61.04 -45.28 98.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.153 177.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -60.3 -14.84 20.36 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 125.108 1.363 . . . . 0.0 114.49 -176.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -69.76 -39.29 76.8 Favored 'General case' 0 N--CA 1.408 -2.534 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 177.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.477 HG13 ' HB2' ' A' ' 71' ' ' MET . 18.7 m -110.49 -15.86 9.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.028 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.742 -174.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -71.49 104.91 3.4 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -177.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.41 -26.6 24.65 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.173 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.73 -11.93 38.14 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -176.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 59.63 60.7 8.27 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.787 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -108.03 -17.36 14.06 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.81 23.51 38.63 Favored Glycine 0 N--CA 1.426 -1.986 0 N-CA-C 109.207 -1.557 . . . . 0.0 109.207 -172.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 57.3 p -139.14 136.11 34.77 Favored 'General case' 0 C--O 1.27 2.165 0 C-N-CA 122.593 0.357 . . . . 0.0 110.321 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 54.6 mt -91.7 104.7 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.127 0 N-CA-C 105.003 -2.221 . . . . 0.0 105.003 174.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -82.49 153.4 25.61 Favored 'General case' 0 C--N 1.285 -2.213 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 -176.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.41 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 76.1 t80 -45.08 -52.73 18.82 Favored Pre-proline 0 N--CA 1.487 1.4 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -176.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.41 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 7.1 Cg_endo -49.54 -42.64 41.72 Favored 'Trans proline' 0 C--N 1.367 1.537 0 C-N-CA 122.842 2.361 . . . . 0.0 112.65 175.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -73.47 -34.09 65.19 Favored 'General case' 0 CA--C 1.508 -0.664 0 C-N-CA 122.884 0.473 . . . . 0.0 110.304 -178.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -62.8 -39.5 94.46 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.14 -47.47 79.83 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.858 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.4 m -57.64 -41.52 81.55 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.418 0.687 . . . . 0.0 110.281 178.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.477 ' HB2' HG13 ' A' ' 55' ' ' VAL . 31.5 ttp -57.58 -45.01 85.78 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.204 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 26.3 mmt -77.42 -38.88 48.72 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.508 -177.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.44 -46.48 88.62 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 123.35 0.407 . . . . 0.0 111.137 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 66.2 mtp180 -56.42 -31.64 64.1 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.602 0.715 . . . . 0.0 111.758 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -88.13 -25.81 22.8 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.459 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.2 ttp . . . . . 0 C--N 1.31 -1.136 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.699 -175.525 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.1 -46.23 90.3 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -175.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -67.52 -35.9 79.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.036 0.446 . . . . 0.0 110.882 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.9 mm -73.3 -41.68 57.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-O 121.952 0.882 . . . . 0.0 109.217 -176.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -74.25 -34.09 63.5 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.831 -178.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.17 -46.89 88.65 Favored 'General case' 0 CA--C 1.501 -0.905 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.439 ' O ' HG11 ' A' ' 91' ' ' VAL . . . -56.37 -45.77 80.37 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 113.911 -1.495 . . . . 0.0 110.943 177.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -67.21 -45.84 75.64 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 119.739 -0.784 . . . . 0.0 110.863 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -67.07 -22.56 65.84 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -177.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.439 HG11 ' O ' ' A' ' 88' ' ' ALA . 8.1 p -78.88 -21.65 12.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 C-N-CA 119.771 -0.771 . . . . 0.0 110.067 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -94.47 -39.24 10.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.48 175.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -109.27 92.65 4.13 Favored 'General case' 0 C--O 1.245 0.823 0 CA-C-O 121.8 0.81 . . . . 0.0 109.589 174.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -51.47 9.73 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 114.06 -1.427 . . . . 0.0 111.899 -174.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -85.4 -12.37 52.24 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -171.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.23 55.12 1.75 Allowed Glycine 0 N--CA 1.432 -1.612 0 C-N-CA 119.771 -1.204 . . . . 0.0 110.997 177.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -83.21 -18.38 39.5 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.58 -15.54 40.71 Favored Glycine 0 CA--C 1.501 -0.803 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.595 175.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.518 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 73.0 m-85 -140.04 134.4 31.34 Favored 'General case' 0 N--CA 1.417 -2.079 0 N-CA-C 107.275 -1.379 . . . . 0.0 107.275 -179.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.0 mt -75.27 135.52 27.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.713 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 177.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.5 m -105.97 139.58 40.29 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -177.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.55 -47.7 80.52 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.613 0.598 . . . . 0.0 112.613 -175.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.6 -43.14 97.77 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.675 -178.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -66.09 -40.86 91.14 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.099 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.5 ' O ' ' HG2' ' A' ' 109' ' ' MET . 7.0 tt -62.59 -39.28 93.22 Favored 'General case' 0 C--O 1.215 -0.75 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -68.34 -30.37 69.31 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.305 0.574 . . . . 0.0 109.943 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -69.88 -45.04 68.55 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.736 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.57 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.7 p -64.59 -29.23 46.78 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.471 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.5 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 19.3 mmt -59.53 -49.61 77.13 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 177.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 23.0 m -60.09 -34.77 73.92 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 121.001 0.429 . . . . 0.0 110.061 177.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -70.77 -33.49 70.83 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.087 0.555 . . . . 0.0 110.906 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 72.6 mt -81.4 -8.17 59.69 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.335 0.588 . . . . 0.0 110.565 -178.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.36 19.45 30.2 Favored Glycine 0 N--CA 1.432 -1.612 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.996 179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -98.55 177.02 5.46 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -151.28 48.07 0.83 Allowed 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.928 0.871 . . . . 0.0 109.162 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.2 mt -76.16 143.99 40.83 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.186 -176.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 44.4 p -78.0 170.61 16.31 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.256 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -70.17 -20.65 63.12 Favored 'General case' 0 C--O 1.206 -1.234 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.907 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -71.39 -45.05 63.78 Favored 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 123.485 0.491 . . . . 0.0 110.28 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -65.24 -45.3 85.18 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.964 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 12.8 m -72.57 -27.89 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.39 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.62 -46.29 79.84 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.664 174.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -64.1 -34.19 77.48 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.556 -177.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 65.2 mtt -57.7 -57.72 11.51 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.179 175.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.5 mm -61.56 -56.43 17.84 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.186 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.857 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 -53.01 -44.06 67.0 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 124.909 1.283 . . . . 0.0 113.285 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -87.06 -7.77 57.75 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.957 -175.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -95.43 -30.79 13.7 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 173.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -66.21 102.37 0.83 Allowed 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 125.772 1.629 . . . . 0.0 109.013 173.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.4 mt -81.76 -44.65 20.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.766 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.941 -174.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -73.73 -11.58 60.44 Favored 'General case' 0 C--O 1.243 0.717 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.43 44.72 20.87 Favored Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.51 -0.853 . . . . 0.0 111.252 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -98.03 -16.18 19.73 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.106 0.479 . . . . 0.0 110.126 -177.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.52 4.27 64.13 Favored Glycine 0 C--O 1.241 0.571 0 C-N-CA 120.463 -0.875 . . . . 0.0 111.107 -177.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.518 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 41.7 mt-30 -137.73 151.61 48.38 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 1.3 p -114.7 116.33 52.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 C-N-CA 119.898 -0.721 . . . . 0.0 112.893 -179.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.42 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 27.9 t30 -75.55 157.57 33.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.311 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -50.52 -49.04 56.78 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.359 1.064 . . . . 0.0 110.726 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -64.02 -24.73 67.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.985 -177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -85.1 -42.21 15.01 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -63.25 -44.62 94.65 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.431 178.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.92 -30.19 49.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.68 0.276 . . . . 0.0 111.735 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -71.15 -44.06 66.31 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 121.614 0.721 . . . . 0.0 109.935 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 12.9 tmm? -75.41 -40.0 58.35 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.342 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.8 ttt . . . . . 0 C--N 1.325 -0.491 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -178.607 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt . . . . . 0 CA--C 1.496 -1.127 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.76 -31.41 72.37 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 123.703 0.627 . . . . 0.0 109.346 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.79 -56.11 9.06 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.592 177.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 49.3 m95 -59.43 -42.05 90.97 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . 0.415 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.7 OUTLIER -52.43 -60.48 3.18 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.339 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -56.13 -47.7 77.65 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.506 -1.679 . . . . 0.0 111.159 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.66 -59.67 4.58 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 123.421 0.688 . . . . 0.0 112.81 -176.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 86.9 mt -54.51 -51.27 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 O-C-N 123.793 0.683 . . . . 0.0 111.839 -174.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . 0.406 ' OE1' ' HE2' ' B' ' 86' ' ' LYS . 49.1 mt-30 -62.66 -44.27 96.69 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.096 -174.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' B' ' 91' ' ' LYS 0.296 19.4 ptmt -81.62 -19.67 41.33 Favored 'General case' 0 C--O 1.21 -0.998 0 C-N-CA 119.256 -0.978 . . . . 0.0 113.447 179.627 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.37 -38.45 81.41 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.453 -0.779 . . . . 0.0 109.216 173.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? . . . . . 0 CA--C 1.545 0.755 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.601 178.786 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.2 tp . . . . . 0 N--CA 1.43 -1.43 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.599 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 38.2 p -72.67 142.9 48.26 Favored 'General case' 0 N--CA 1.427 -1.6 0 C-N-CA 119.223 -0.991 . . . . 0.0 108.864 176.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -71.58 -18.05 62.26 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 112.98 0.734 . . . . 0.0 112.98 -172.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -71.05 -36.52 72.34 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.599 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 6.8 mm100 -70.11 -39.89 75.22 Favored 'General case' 0 C--O 1.196 -1.743 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 177.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.44 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 32.0 mt -59.93 -39.11 79.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.039 176.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.88 -47.26 85.8 Favored 'General case' 0 C--O 1.246 0.914 0 C-N-CA 123.308 0.643 . . . . 0.0 111.064 176.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -63.46 -42.09 98.61 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.801 178.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.535 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 14.9 m-30 -65.37 -34.72 78.97 Favored 'General case' 0 C--O 1.187 -2.212 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.085 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 97.3 mttt -57.03 -43.45 81.89 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.245 0.341 . . . . 0.0 110.89 174.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -59.68 -61.15 2.83 Favored 'General case' 0 C--O 1.258 1.509 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.576 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.64 -26.56 67.86 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.797 -177.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.535 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 30.9 t80 -61.37 -47.6 85.11 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 123.332 0.653 . . . . 0.0 110.503 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.1 m -75.28 -16.93 60.4 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.164 0.507 . . . . 0.0 110.977 178.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.34 -36.64 79.56 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 172.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -84.25 -41.79 16.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.025 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -80.74 99.14 8.07 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.453 ' HZ2' ' HB2' ' A' ' 21' ' ' LYS . 10.0 mtmp? -73.6 -1.68 19.8 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -172.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -116.75 -14.38 10.77 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 117.996 -1.482 . . . . 0.0 112.014 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.53 28.34 33.02 Favored Glycine 0 C--N 1.309 -0.929 0 C-N-CA 120.28 -0.962 . . . . 0.0 112.637 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -101.2 -17.44 16.62 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.197 0.523 . . . . 0.0 109.788 178.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.58 20.45 76.64 Favored Glycine 0 N--CA 1.437 -1.262 0 CA-C-N 115.537 -0.756 . . . . 0.0 114.733 176.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.6 p -132.04 128.69 38.82 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 171.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.7 mt -104.31 115.75 46.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.846 0 O-C-N 121.873 -0.517 . . . . 0.0 109.731 -174.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -83.61 173.35 11.48 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.043 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.1 p -61.87 -43.05 99.64 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 120.864 0.364 . . . . 0.0 111.022 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -64.91 -35.08 79.99 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.656 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.77 -45.35 68.23 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.083 177.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.9 mt -54.59 -55.72 26.47 Favored 'General case' 0 C--O 1.201 -1.477 0 O-C-N 124.133 0.895 . . . . 0.0 110.723 177.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.25 -31.69 77.96 Favored Glycine 0 CA--C 1.522 0.508 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.486 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.3 m -70.95 -48.77 51.62 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 117.285 0.542 . . . . 0.0 110.686 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.4 m -68.39 -35.11 69.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.637 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.238 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 64.5 mtt -65.82 -33.03 74.92 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.149 177.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -62.67 -41.94 99.35 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -68.23 -20.43 64.82 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.706 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.45 ' C ' ' HD2' ' B' ' 91' ' ' LYS . 4.3 mm? -101.0 13.85 33.87 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.048 0.452 . . . . 0.0 112.152 177.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.97 26.98 61.15 Favored Glycine 0 C--O 1.241 0.575 0 N-CA-C 114.564 0.586 . . . . 0.0 114.564 173.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -127.07 124.41 39.19 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -119.27 78.01 18.22 Favored Pre-proline 0 C--N 1.298 -1.639 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -89.31 160.09 5.59 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 122.29 1.993 . . . . 0.0 112.1 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 39.6 p -80.85 159.98 24.9 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.68 -26.59 68.45 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 120.687 0.28 . . . . 0.0 110.656 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.68 -46.92 85.95 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.105 0.479 . . . . 0.0 110.037 175.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -66.6 -35.02 79.18 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.331 178.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.444 ' O ' HG13 ' A' ' 52' ' ' ILE . 97.1 mt -66.01 -49.87 66.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.983 177.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -58.43 -43.68 88.81 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 122.959 0.503 . . . . 0.0 110.789 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -65.32 -40.77 94.14 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.083 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.8 tpt -62.27 -42.34 99.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.426 0.631 . . . . 0.0 109.582 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 48' ' ' LEU . 79.5 mt -62.21 -48.98 85.88 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.922 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.913 177.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -52.5 -37.09 56.63 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -174.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -66.43 -28.33 68.52 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.09 -1.044 . . . . 0.0 111.637 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.41 HG13 ' HB2' ' A' ' 71' ' ' MET . 7.8 m -101.58 -20.84 5.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.565 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -72.59 111.81 8.09 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 123.904 0.882 . . . . 0.0 111.182 -174.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.87 -16.05 37.22 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.604 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -98.19 -12.42 21.71 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 -177.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.11 31.91 62.42 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -173.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.3 p-10 -98.31 -5.42 32.97 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -172.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.58 23.55 39.2 Favored Glycine 0 N--CA 1.44 -1.05 0 C-N-CA 120.087 -1.054 . . . . 0.0 112.458 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.24 139.95 30.46 Favored 'General case' 0 C--O 1.253 1.279 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 178.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 65.2 mt -92.66 111.75 24.95 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -85.41 166.11 16.66 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.443 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 70.7 t80 -56.17 -53.63 61.47 Favored Pre-proline 0 CA--C 1.554 1.127 0 O-C-N 123.425 0.453 . . . . 0.0 112.114 179.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.443 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -51.94 -37.35 66.99 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.927 2.418 . . . . 0.0 112.383 175.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -74.55 -33.55 62.75 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.458 0.647 . . . . 0.0 110.3 -177.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -68.21 -36.8 80.1 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 87.3 mt -61.73 -47.04 87.05 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.396 175.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.8 m -56.24 -47.02 79.33 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 123.764 0.665 . . . . 0.0 110.827 177.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.41 ' HB2' HG13 ' A' ' 55' ' ' VAL . 28.3 ttp -57.58 -42.25 82.76 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 123.205 0.602 . . . . 0.0 111.551 179.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 25.1 mmt -75.28 -44.92 43.11 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.434 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.26 77.48 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.927 0.394 . . . . 0.0 110.227 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -63.87 -46.49 84.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.582 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -62.24 -51.74 66.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.394 -175.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.0 ttm . . . . . 0 C--N 1.31 -1.13 0 C-N-CA 125.169 1.388 . . . . 0.0 112.528 -177.892 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 . . . . . 0 C--O 1.209 -1.063 0 N-CA-C 110.937 -0.023 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -70.25 -56.39 6.89 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 116.891 -0.14 . . . . 0.0 111.053 -172.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -63.61 -28.75 70.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.806 0.813 . . . . 0.0 109.878 178.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.5 mm -70.96 -52.74 25.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-N 114.464 -1.243 . . . . 0.0 109.646 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 35.4 ttm180 -71.31 -35.83 71.39 Favored 'General case' 0 C--O 1.204 -1.304 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.13 -176.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -58.26 -37.59 75.24 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 123.257 0.348 . . . . 0.0 111.502 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -70.25 -39.23 75.15 Favored 'General case' 0 C--O 1.211 -0.923 0 O-C-N 123.484 0.49 . . . . 0.0 110.849 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -71.52 -45.39 62.52 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.457 0.646 . . . . 0.0 109.899 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -64.3 -28.3 69.62 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 125.824 1.65 . . . . 0.0 111.974 -176.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 88' ' ' ALA . 8.4 p -77.81 -22.61 13.9 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.877 -179.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -89.3 -56.81 3.12 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 174.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -91.4 80.95 5.45 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 122.136 0.97 . . . . 0.0 109.159 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.497 ' H ' ' HD2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -78.53 -30.17 46.88 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.51 -1.223 . . . . 0.0 113.572 -175.688 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.8 -13.49 59.38 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.516 0.674 . . . . 0.0 110.612 -178.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.62 76.16 0.8 Allowed Glycine 0 N--CA 1.438 -1.202 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.01 177.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -110.72 -19.25 12.92 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.199 0.523 . . . . 0.0 109.854 178.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.62 0.98 87.78 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.91 176.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -141.31 145.44 35.48 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -178.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.8 mt -105.5 113.54 42.68 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.6 m -96.46 156.58 16.28 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.88 -39.95 96.04 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 117.748 0.249 . . . . 0.0 111.04 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.51 -44.44 96.01 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 123.399 0.437 . . . . 0.0 110.569 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -65.39 -49.74 68.15 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.277 177.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.441 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.3 tm? -60.79 -40.57 93.14 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 115.305 -0.862 . . . . 0.0 108.746 -174.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -59.47 -47.14 86.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 176.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -55.49 -52.73 62.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.725 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.699 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.8 p -66.2 -37.63 80.16 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.553 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.358 -177.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.441 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.9 mmt -60.69 -41.32 94.94 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.7 m -58.82 -41.31 86.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 175.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -74.49 -24.02 58.95 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.443 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 84.1 mt -87.61 -19.62 27.53 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.097 0.475 . . . . 0.0 110.098 -178.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 83.19 35.05 19.09 Favored Glycine 0 N--CA 1.43 -1.745 0 C-N-CA 120.892 -0.671 . . . . 0.0 111.543 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -98.83 132.95 43.79 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -84.5 46.22 1.21 Allowed 'General case' 0 C--N 1.292 -1.935 0 C-N-CA 123.473 0.709 . . . . 0.0 110.951 -176.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 38.2 mt -86.2 129.52 34.82 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.7 p -79.01 168.44 19.68 Favored 'General case' 0 C--N 1.297 -1.704 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.479 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.445 ' O ' HG23 ' A' ' 121' ' ' VAL . 25.0 t70 -61.51 -50.73 71.54 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -176.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -60.38 -32.87 71.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.486 0.66 . . . . 0.0 109.719 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -71.52 -43.42 66.49 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.873 -178.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 118' ' ' ASP . 17.5 m -68.98 -32.55 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 177.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -67.23 -45.57 76.35 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.529 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -72.06 -32.59 67.22 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.687 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.5 tpp -53.28 -49.22 67.4 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 172.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.0 mm -67.15 -48.33 79.01 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.208 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.531 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -57.67 -33.75 68.67 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.702 0.801 . . . . 0.0 112.259 -175.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -82.76 -23.82 33.78 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.163 0.506 . . . . 0.0 111.189 -178.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -87.98 -24.05 23.65 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.668 0.746 . . . . 0.0 109.522 177.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.485 ' OD2' ' HA2' ' A' ' 132' ' ' GLY . 5.0 t70 -69.96 99.72 1.47 Allowed 'General case' 0 C--N 1.309 -1.152 0 C-N-CA 125.825 1.65 . . . . 0.0 109.763 175.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.6 mt -82.33 -47.76 18.73 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -73.84 -10.68 59.91 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 121.203 0.525 . . . . 0.0 110.997 -176.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.485 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 72.56 52.21 10.6 Favored Glycine 0 N--CA 1.437 -1.286 0 N-CA-C 110.282 -1.127 . . . . 0.0 110.282 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -106.46 -17.37 14.29 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -177.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.64 -9.37 52.3 Favored Glycine 0 N--CA 1.437 -1.251 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.245 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -133.3 137.3 45.92 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 -178.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 1.3 p -88.14 116.92 30.87 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 CA-C-O 121.589 0.709 . . . . 0.0 110.469 177.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -84.5 159.58 20.7 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 114.832 -1.077 . . . . 0.0 109.819 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.488 ' O ' HG11 ' A' ' 142' ' ' VAL . 77.0 t80 -54.85 -46.74 74.71 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 123.858 0.863 . . . . 0.0 111.328 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.2 -22.34 65.84 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -87.77 -43.3 11.97 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.57 -35.47 81.09 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.941 -178.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.488 HG11 ' O ' ' A' ' 138' ' ' TYR . 32.6 m -58.38 -35.89 56.07 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.924 0 CA-C-O 120.933 0.397 . . . . 0.0 110.908 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -75.43 -21.05 58.48 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.41 -178.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 92.4 mmm -76.98 -35.42 57.2 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 90.6 mmm . . . . . 0 N--CA 1.427 -1.619 0 CA-C-N 113.455 -1.702 . . . . 0.0 110.362 177.627 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . 0.514 ' O ' ' HG3' ' B' ' 86' ' ' LYS . 87.4 tttt . . . . . 0 C--O 1.225 -0.209 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -59.8 -50.93 71.9 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 176.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.46 -41.81 98.62 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 113.468 -1.696 . . . . 0.0 111.303 177.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 74.1 m95 -58.02 -36.43 72.69 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 177.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . 0.514 ' HG3' ' O ' ' B' ' 82' ' ' LYS . 89.1 mttt -52.6 -34.88 52.84 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.483 0.658 . . . . 0.0 110.171 177.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -85.02 -54.28 4.75 Favored 'General case' 0 C--O 1.205 -1.283 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.891 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.0 -51.63 51.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.904 0.882 . . . . 0.0 112.748 -176.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 50.4 mm -61.32 -53.35 49.9 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.427 0 CA-C-O 121.543 0.687 . . . . 0.0 109.604 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -69.31 -32.43 71.56 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.624 -1.171 . . . . 0.0 112.173 -171.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . 0.45 ' HD2' ' C ' ' A' ' 39' ' ' LEU . 22.3 tptm -67.71 -39.44 84.35 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.373 0.669 . . . . 0.0 109.699 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.42 -51.45 7.83 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.79 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 45.6 tptt . . . . . 0 N--CA 1.443 -0.817 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.953 -177.057 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.44 ' HB3' HD11 ' A' ' 9' ' ' ILE . 13.3 tp . . . . . 0 N--CA 1.423 -1.811 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.7 p -90.64 157.02 17.7 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 122.848 0.459 . . . . 0.0 111.372 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -51.29 -49.84 60.48 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 -174.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -40.67 95.95 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -176.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -67.27 -44.05 80.3 Favored 'General case' 0 C--O 1.211 -0.931 0 O-C-N 123.52 0.513 . . . . 0.0 110.015 176.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.511 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 78.5 mt -62.52 -42.4 95.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.614 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.41 -35.76 81.12 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-O 121.555 0.693 . . . . 0.0 110.205 178.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -63.27 -49.99 71.92 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.923 178.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.437 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 42.1 m-85 -71.12 -24.0 62.2 Favored 'General case' 0 C--O 1.177 -2.759 0 CA-C-N 114.88 -1.054 . . . . 0.0 112.459 -179.187 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.1 mttt -62.95 -40.92 99.12 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 119.056 0.843 . . . . 0.0 110.023 174.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -58.81 -56.38 22.95 Favored 'General case' 0 C--O 1.25 1.1 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.119 178.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.448 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -72.61 -23.76 60.98 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.281 -176.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.437 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 47.5 t80 -64.84 -44.34 90.13 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 177.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.8 t -75.76 -16.94 60.06 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.864 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.448 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 38.6 tp -72.18 -41.51 66.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.054 174.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -80.41 -40.45 26.41 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.223 178.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -72.44 99.05 2.38 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -83.63 1.73 40.89 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -174.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.571 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 10.4 m-20 -105.68 -13.9 15.42 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.533 179.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.92 34.52 55.77 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.85 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.571 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 2.6 p30 -113.29 -16.88 12.44 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -178.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.73 33.6 33.6 Favored Glycine 0 C--N 1.311 -0.809 0 N-CA-C 114.999 0.76 . . . . 0.0 114.999 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.7 p -149.28 129.04 13.27 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 171.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 60.0 mt -99.18 120.19 48.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-O 121.298 0.571 . . . . 0.0 112.074 -170.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.0 p -93.45 175.18 6.85 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.993 178.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 46.2 p -67.58 -25.52 65.82 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.493 0.664 . . . . 0.0 109.734 176.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -57.89 -57.05 14.48 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.014 175.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -65.11 -40.73 94.94 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.373 -177.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.7 -52.55 64.99 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 123.488 0.492 . . . . 0.0 110.547 175.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.79 -31.05 78.59 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.312 -0.947 . . . . 0.0 112.798 -178.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.0 m -72.74 -43.22 63.19 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 117.467 0.634 . . . . 0.0 111.226 178.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.601 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 35.0 m -67.43 -36.06 75.31 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.422 176.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.471 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 66.2 mtt -67.48 -35.09 78.49 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.187 177.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -61.1 -38.72 87.28 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.3 t -72.02 -28.3 63.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.809 177.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 80.4 mt -78.91 -20.15 50.09 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.881 0.372 . . . . 0.0 110.505 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.37 32.46 7.36 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 121.373 -0.442 . . . . 0.0 112.27 179.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.411 ' C ' HD21 ' A' ' 42' ' ' ASN . 36.1 tt0 -145.18 139.53 27.3 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.411 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -126.25 80.03 69.21 Favored Pre-proline 0 C--N 1.3 -1.573 0 O-C-N 121.773 -0.579 . . . . 0.0 112.403 -179.058 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.471 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 21.9 Cg_exo -69.82 149.43 66.53 Favored 'Trans proline' 0 C--O 1.242 0.705 0 C-N-CA 121.82 1.68 . . . . 0.0 109.447 173.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.1 p -78.95 162.53 25.92 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -174.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -44.49 -56.44 4.29 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 126.162 1.785 . . . . 0.0 113.657 -174.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.95 -34.52 76.74 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -175.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -60.78 -45.47 94.23 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.431 ' O ' HG13 ' A' ' 52' ' ' ILE . 96.7 mt -60.83 -43.19 98.59 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.991 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -73.55 -31.78 63.84 Favored 'General case' 0 N--CA 1.44 -0.927 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.448 -178.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.487 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 31.2 t70 -67.27 -40.06 86.12 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 119.719 -0.792 . . . . 0.0 109.577 175.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.462 ' HE3' ' HA ' ' A' ' 51' ' ' MET . 2.8 tpt -59.37 -37.2 77.3 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.368 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 48' ' ' LEU . 45.5 mt -66.41 -50.93 63.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.725 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.772 174.37 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -59.81 -23.12 63.07 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 124.016 0.926 . . . . 0.0 112.724 -173.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 17.0 mm-40 -62.0 -36.94 83.02 Favored 'General case' 0 N--CA 1.396 -3.143 0 C-N-CA 124.479 1.112 . . . . 0.0 111.164 175.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.529 HG12 ' SD ' ' A' ' 71' ' ' MET . 28.9 m -109.02 -14.41 10.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.761 0.315 . . . . 0.0 111.383 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -72.61 114.14 10.42 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.72 -18.91 30.02 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.964 -177.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -97.12 -12.37 23.21 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.57 37.06 88.03 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 -174.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.0 p-10 -101.49 -7.65 22.65 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.36 18.37 28.75 Favored Glycine 0 N--CA 1.436 -1.324 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.937 173.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 p -143.64 142.48 31.04 Favored 'General case' 0 C--O 1.253 1.276 0 CA-C-N 116.731 0.265 . . . . 0.0 110.436 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.9 mt -92.19 108.89 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.64 169.7 15.96 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.431 ' CE2' HD13 ' A' ' 69' ' ' LEU . 52.6 t80 -58.59 -55.88 41.32 Favored Pre-proline 0 CA--C 1.554 1.11 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -176.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.01 -37.08 78.3 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.498 2.132 . . . . 0.0 112.117 176.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -70.25 -39.84 74.79 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.009 0.433 . . . . 0.0 110.433 -178.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -66.08 -39.85 90.36 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.431 HD13 ' CE2' ' A' ' 65' ' ' PHE . 83.4 mt -65.35 -45.24 84.95 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.354 177.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 89.1 m -56.96 -44.71 82.87 Favored 'General case' 0 C--O 1.239 0.535 0 O-C-N 123.466 0.479 . . . . 0.0 109.976 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.529 ' SD ' HG12 ' A' ' 55' ' ' VAL . 32.5 ttp -58.9 -49.13 78.95 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.879 177.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.5 mmt -62.52 -43.84 97.84 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.73 -24.69 66.97 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.087 0.47 . . . . 0.0 111.476 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.9 mtp180 -82.77 -41.54 19.05 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.386 0.613 . . . . 0.0 109.497 175.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -67.99 -28.71 67.67 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.705 -1.134 . . . . 0.0 111.623 -172.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 73.8 mtm . . . . . 0 C--N 1.304 -1.391 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.138 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 121.526 0.679 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.542 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 1.6 mp0 -70.23 -33.25 71.43 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.717 178.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -64.02 -46.66 83.51 Favored 'General case' 0 CA--C 1.492 -1.266 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.9 mm -64.73 -35.77 75.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 114.759 -1.11 . . . . 0.0 109.311 -176.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -64.14 -49.76 70.89 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.444 175.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 83' ' ' GLU . 40.4 mm-40 -64.41 -36.15 83.22 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.849 0.356 . . . . 0.0 111.83 -176.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.2 -28.06 67.77 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.583 177.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -80.51 -49.55 11.22 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.594 0.712 . . . . 0.0 109.097 176.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -53.94 -30.91 48.58 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 126.379 1.872 . . . . 0.0 112.681 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.447 HG23 ' O ' ' B' ' 92' ' ' ALA . 14.2 p -70.8 -29.39 37.51 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.641 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -86.24 -49.47 7.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 176.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -88.44 79.33 7.7 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.975 179.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' A' ' 91' ' ' VAL . 70.7 mmtt -75.53 -30.55 59.81 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.621 -177.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -85.37 -12.48 52.07 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -177.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.81 51.6 6.29 Favored Glycine 0 CA--C 1.502 -0.733 0 C-N-CA 120.77 -0.729 . . . . 0.0 111.678 177.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.42 ' N ' HD21 ' A' ' 97' ' ' ASN . 0.9 OUTLIER -90.31 -17.96 26.43 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 123.073 0.549 . . . . 0.0 110.053 -179.423 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.15 9.56 79.89 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.456 178.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 39.7 p90 -157.28 156.96 33.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.433 ' HB ' HG11 ' A' ' 136' ' ' VAL . 4.0 mt -105.21 134.88 45.44 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.0 t -107.59 151.01 26.19 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 177.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.12 -55.87 29.5 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -175.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.0 -26.94 68.5 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.137 0.494 . . . . 0.0 110.965 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.95 -40.49 65.35 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.515 177.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.4 tt -63.56 -39.43 94.38 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.474 ' HD2' ' O ' ' A' ' 106' ' ' ARG . 4.2 tmm_? -66.76 -38.49 86.7 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -59.73 -48.75 80.45 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.048 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.597 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.8 p -65.02 -33.42 63.62 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.298 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.099 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.483 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.7 mmt -59.72 -45.51 91.96 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-O 120.751 0.31 . . . . 0.0 111.569 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 23.7 m -64.69 -29.75 70.75 Favored 'General case' 0 CA--C 1.563 1.459 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.214 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.73 -24.35 41.68 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.105 0.479 . . . . 0.0 111.091 177.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 77.3 mt -89.17 -19.95 24.84 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.722 0.409 . . . . 0.0 111.01 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.27 24.97 9.79 Favored Glycine 0 C--N 1.308 -1.014 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.905 -178.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -111.1 154.44 24.27 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 121.412 0.625 . . . . 0.0 109.5 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -124.09 104.68 9.01 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.207 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 61.7 mt -124.52 151.75 44.27 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 35.7 p -86.85 169.63 12.38 Favored 'General case' 0 C--N 1.29 -2.012 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -66.18 -35.13 79.66 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.96 -43.69 94.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.047 175.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -65.57 -53.65 38.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.885 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.437 ' O ' HG12 ' A' ' 125' ' ' ILE . 23.1 m -65.36 -36.47 77.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.566 -176.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -69.08 -34.3 74.91 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 120.893 0.378 . . . . 0.0 110.441 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.41 -40.51 77.25 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.2 mtt -56.62 -50.99 70.37 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.701 176.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.2 mm -58.02 -45.52 88.07 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 O-C-N 123.919 0.762 . . . . 0.0 109.484 178.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.6 ttp-105 -58.92 -31.74 68.93 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -176.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 128' ' ' ALA . 0.4 OUTLIER -79.4 -32.82 43.07 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 117.974 -1.49 . . . . 0.0 109.931 178.357 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.438 ' N ' ' HG3' ' A' ' 127' ' ' GLU . . . -84.75 -24.76 28.67 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.582 -175.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.413 ' OD2' ' HA2' ' A' ' 132' ' ' GLY . 18.9 t70 -73.51 89.53 1.69 Allowed 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 124.117 0.967 . . . . 0.0 108.584 175.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 84.7 mt -82.84 -35.85 12.69 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.926 -174.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -81.31 -9.29 59.78 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.561 0.696 . . . . 0.0 111.296 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.413 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 73.08 49.57 15.82 Favored Glycine 0 CA--C 1.499 -0.908 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.697 175.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -115.47 -16.46 11.38 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-O 121.385 0.612 . . . . 0.0 110.942 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.0 5.35 60.97 Favored Glycine 0 C--N 1.304 -1.205 0 N-CA-C 111.097 -0.801 . . . . 0.0 111.097 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -131.73 125.21 31.43 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.433 HG11 ' HB ' ' A' ' 100' ' ' ILE . 1.2 p -94.58 111.28 25.14 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.833 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.357 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -85.85 168.98 13.75 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.431 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.569 ' O ' HG11 ' A' ' 142' ' ' VAL . 92.5 t80 -57.18 -45.77 83.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.103 -176.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.467 ' O ' HG23 ' A' ' 142' ' ' VAL . 10.8 pt-20 -61.91 -27.95 69.18 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.31 0.576 . . . . 0.0 111.678 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -82.39 -41.02 20.47 Favored 'General case' 0 N--CA 1.414 -2.259 0 CA-C-O 122.126 0.965 . . . . 0.0 108.458 -177.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -60.12 -44.65 94.72 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.74 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.569 HG11 ' O ' ' A' ' 138' ' ' TYR . 19.7 m -56.33 -33.85 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 CA-C-O 121.126 0.489 . . . . 0.0 112.193 -177.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -80.09 -50.9 9.68 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.521 -174.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -24.09 63.09 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.408 -176.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.446 -0.627 0 C-N-CA 120.646 -0.422 . . . . 0.0 112.004 178.903 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 86.2 tttt . . . . . 0 C--O 1.246 0.882 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -71.41 -22.65 61.83 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.11 177.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.57 -44.45 90.67 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 52.7 m95 -71.06 -36.06 72.16 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.092 175.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -57.19 -54.08 50.84 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 178.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -59.4 -46.14 89.53 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.573 -1.649 . . . . 0.0 111.104 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.2 -55.84 29.77 Favored 'General case' 0 CA--C 1.503 -0.837 0 O-C-N 123.283 0.364 . . . . 0.0 111.122 -179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 50.5 mm -60.04 -47.3 92.37 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.711 0 O-C-N 123.524 0.515 . . . . 0.0 110.227 -178.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -54.77 -51.98 64.0 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 123.239 0.616 . . . . 0.0 112.141 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 19.8 tptm -69.84 -35.89 75.11 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.097 0.475 . . . . 0.0 111.572 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . 0.447 ' O ' HG23 ' A' ' 91' ' ' VAL . . . -77.82 -34.16 52.13 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.237 -177.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? . . . . . 0 N--CA 1.475 0.798 0 C-N-CA 124.535 1.134 . . . . 0.0 109.362 -178.97 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.474 ' HG ' ' HB2' ' A' ' 8' ' ' GLN . 9.1 tp . . . . . 0 N--CA 1.426 -1.635 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.451 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 71.4 p -84.44 159.2 20.83 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 119.519 -0.872 . . . . 0.0 109.591 177.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.61 -30.76 71.59 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 111.946 0.351 . . . . 0.0 111.946 -175.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -57.54 -46.11 84.28 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 177.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.474 ' HB2' ' HG ' ' A' ' 4' ' ' LEU . 60.3 mm-40 -65.75 -51.72 56.92 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.408 -179.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.428 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 78.8 mt -57.83 -36.99 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.73 -176.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 13' ' ' LYS . . . -67.26 -40.84 86.26 Favored 'General case' 0 C--O 1.254 1.29 0 CA-C-O 121.594 0.711 . . . . 0.0 110.6 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -64.64 -40.81 96.1 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.375 -0.83 . . . . 0.0 108.995 176.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -60.8 -38.16 84.42 Favored 'General case' 0 C--O 1.162 -3.516 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.307 174.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 10' ' ' ALA . 32.8 mmtp -52.46 -56.47 14.85 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-N 118.318 0.508 . . . . 0.0 111.155 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -64.85 -51.27 62.99 Favored 'General case' 0 C--O 1.25 1.113 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.18 -37.55 87.87 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.996 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -59.8 -42.63 93.85 Favored 'General case' 0 C--O 1.206 -1.205 0 C-N-CA 123.489 0.716 . . . . 0.0 110.272 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.8 m -68.32 -23.69 64.75 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 123.516 0.51 . . . . 0.0 110.742 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.7 tt -73.27 -31.25 63.96 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 121.365 0.602 . . . . 0.0 109.441 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -87.71 -33.04 18.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.475 179.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -79.52 90.61 5.1 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -64.47 -47.06 80.39 Favored 'General case' 0 N--CA 1.428 -1.546 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 -170.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.429 ' OD2' ' HB3' ' A' ' 24' ' ' ASP . 6.7 p-10 -83.2 -13.23 55.84 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.161 -178.112 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.64 58.5 6.35 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 116.008 -0.542 . . . . 0.0 113.145 177.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.429 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 4.8 p-10 -113.62 -15.91 12.43 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 120.991 0.424 . . . . 0.0 110.064 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.33 10.49 38.76 Favored Glycine 0 N--CA 1.43 -1.732 0 CA-C-N 115.962 -0.563 . . . . 0.0 113.955 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 71.2 p -136.75 160.53 38.58 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 118.02 0.91 . . . . 0.0 108.987 175.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.0 mt -120.96 120.4 62.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.152 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.6 p -95.13 175.41 6.63 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.616 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -59.2 -42.75 91.66 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 123.605 0.762 . . . . 0.0 110.606 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -58.73 -44.76 90.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.888 178.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -67.48 -38.69 84.76 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.772 -179.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.23 -46.71 89.27 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.146 176.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.4 -25.19 75.71 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.443 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.9 m -66.71 -54.55 21.77 Favored 'General case' 0 C--O 1.251 1.162 0 CA-C-O 121.31 0.576 . . . . 0.0 109.633 176.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 28.2 m -67.34 -36.13 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.145 -178.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 49.7 mtt -66.48 -44.4 82.79 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 177.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -59.46 -36.38 75.86 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.0 t -67.62 -14.0 62.56 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.005 179.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 59.6 mt -103.2 -11.57 17.92 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.327 177.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.09 -7.07 32.7 Favored Glycine 0 C--N 1.311 -0.851 0 C-N-CA 120.091 -1.052 . . . . 0.0 114.122 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.56 131.3 54.5 Favored 'General case' 0 CA--C 1.483 -1.633 0 CA-C-N 118.013 0.907 . . . . 0.0 110.724 177.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.34 3.5 p30 -135.0 71.69 68.9 Favored Pre-proline 0 C--N 1.284 -2.28 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 173.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.87 157.19 25.11 Favored 'Trans proline' 0 C--N 1.357 1.016 0 C-N-CA 123.276 2.651 . . . . 0.0 111.472 173.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.5 p -78.17 165.18 24.26 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.425 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.84 -40.83 70.02 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 123.541 0.736 . . . . 0.0 112.04 -179.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.68 -43.75 93.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.188 0.518 . . . . 0.0 110.958 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -64.16 -42.66 96.65 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.544 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 87.7 mt -70.41 -38.59 74.64 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.306 -179.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -64.26 -40.49 96.09 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 123.151 0.58 . . . . 0.0 109.603 177.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.59 -35.56 78.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.76 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.51 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 66.5 mmm -74.38 -33.62 63.1 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.822 177.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.5 mt -66.97 -40.81 86.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 121.371 0.605 . . . . 0.0 109.481 175.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -63.66 -12.46 34.09 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.254 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.51 ' HB2' ' O ' ' A' ' 51' ' ' MET . 12.2 mm-40 -67.21 -23.54 65.75 Favored 'General case' 0 N--CA 1.394 -3.268 0 C-N-CA 123.742 0.817 . . . . 0.0 111.354 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.524 ' CG1' ' HB2' ' A' ' 71' ' ' MET . 17.4 m -119.58 -19.94 5.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.973 174.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -78.46 82.28 4.74 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.771 0.796 . . . . 0.0 111.843 -173.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.92 -21.81 26.06 Favored 'General case' 0 C--N 1.299 -1.621 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.434 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -81.78 -11.97 58.76 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.34 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.77 12.54 84.42 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 115.41 0.924 . . . . 0.0 115.41 173.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -80.48 -14.29 58.39 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.962 1.381 . . . . 0.0 110.395 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 79.75 20.34 68.62 Favored Glycine 0 N--CA 1.437 -1.279 0 CA-C-N 115.843 -0.617 . . . . 0.0 113.432 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.97 148.19 39.95 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.2 mt -92.26 116.17 32.82 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 108.758 -0.831 . . . . 0.0 108.758 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.423 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 7.1 t70 -87.14 172.53 9.87 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 174.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.432 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 46.7 t80 -57.13 -51.65 80.07 Favored Pre-proline 0 CA--C 1.555 1.168 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -175.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 8.7 Cg_endo -51.58 -42.48 55.81 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 122.973 2.448 . . . . 0.0 112.6 175.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.85 -39.63 87.66 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.632 0.729 . . . . 0.0 110.067 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -66.38 -40.66 89.84 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.598 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 78.0 mt -63.73 -37.78 88.66 Favored 'General case' 0 C--O 1.206 -1.196 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.987 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.443 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 86.5 m -59.22 -50.88 72.32 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 123.493 0.496 . . . . 0.0 110.912 178.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.524 ' HB2' ' CG1' ' A' ' 55' ' ' VAL . 34.0 ttp -66.03 -36.65 83.82 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.053 0.454 . . . . 0.0 111.84 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.5 mmt -82.22 -24.87 34.64 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.786 -0.766 . . . . 0.0 112.334 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.71 -29.89 67.39 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 173.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.443 ' HG3' ' O ' ' A' ' 70' ' ' THR . 99.8 mtt180 -66.24 -29.86 70.19 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.731 0.777 . . . . 0.0 109.529 174.034 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -81.94 -12.14 58.53 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.937 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.9 ttm . . . . . 0 C--N 1.313 -1.007 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.484 -179.195 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 82' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.44 -0.94 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.596 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 44.0 mt-10 -62.84 -58.47 7.29 Favored 'General case' 0 CA--C 1.489 -1.377 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.943 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -49.6 -45.36 47.94 Favored 'General case' 0 C--O 1.251 1.156 0 C-N-CA 124.817 1.247 . . . . 0.0 110.376 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 40.0 mm -66.75 -50.73 63.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 114.416 -1.265 . . . . 0.0 110.426 -177.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -70.66 -27.68 64.22 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.138 -177.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 51.4 mt-10 -60.08 -44.9 94.44 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 175.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.34 -38.11 81.17 Favored 'General case' 0 C--O 1.21 -1.008 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.831 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.76 -43.6 83.62 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.404 0.621 . . . . 0.0 110.139 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 -66.23 -26.76 67.52 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 124.739 1.216 . . . . 0.0 111.7 -176.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.0 p -83.76 -19.76 9.39 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 C-N-CA 120.308 -0.557 . . . . 0.0 111.287 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -91.3 -49.78 6.17 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 122.037 -0.414 . . . . 0.0 110.012 177.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -84.42 107.38 16.65 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 177.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -73.28 -26.62 61.16 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.342 -172.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -103.81 -14.18 16.14 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.529 0.68 . . . . 0.0 110.789 -176.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.04 45.15 58.14 Favored Glycine 0 N--CA 1.43 -1.725 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -176.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -85.61 -17.83 35.03 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 121.427 0.632 . . . . 0.0 109.644 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 101.45 16.08 25.7 Favored Glycine 0 N--CA 1.434 -1.449 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.515 173.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -146.71 131.39 17.88 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -177.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.1 mt -100.68 126.93 54.24 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.5 t -107.24 144.72 33.63 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.46 94.21 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.208 0.603 . . . . 0.0 111.782 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.56 89.09 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.093 0.473 . . . . 0.0 110.802 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.555 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 5.0 tp10 -72.15 -45.36 60.8 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.498 178.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.498 ' O ' ' HG2' ' A' ' 109' ' ' MET . 8.5 tt -60.23 -37.81 81.49 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 -176.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.409 ' HB2' HG21 ' A' ' 121' ' ' VAL . 45.8 ttt180 -63.14 -37.15 86.06 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.727 177.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . 0.555 ' HB2' ' O ' ' A' ' 104' ' ' GLU . 56.7 m170 -51.98 -53.51 40.66 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.365 177.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.574 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.3 p -71.02 -30.61 42.01 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.621 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.335 -176.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.498 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.2 mmt -63.6 -47.02 83.16 Favored 'General case' 0 CA--C 1.494 -1.209 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.7 m -62.11 -32.75 73.35 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.406 177.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -73.48 -33.57 64.89 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.216 177.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 84.9 mt -84.65 -20.87 30.62 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.009 0.433 . . . . 0.0 110.986 -176.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 89.48 18.12 53.23 Favored Glycine 0 N--CA 1.431 -1.685 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.1 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -84.58 107.57 16.87 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 176.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -70.3 99.63 1.58 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.4 -177.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 62.9 mt -137.1 149.04 47.09 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -89.86 173.83 8.03 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -66.94 -34.17 77.19 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -61.28 -47.41 86.13 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.519 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -62.68 -48.76 77.91 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.459 -177.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.409 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.2 m -66.96 -33.42 63.27 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 CA-C-O 121.014 0.435 . . . . 0.0 110.9 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -74.35 -37.12 63.59 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.0 0.429 . . . . 0.0 109.971 178.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -61.44 -41.6 97.45 Favored 'General case' 0 C--O 1.248 1.025 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.42 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 62.3 mtt -53.71 -56.83 13.9 Favored 'General case' 0 CA--C 1.504 -0.804 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.752 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.9 mm -57.9 -50.57 77.38 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.724 0 CA-C-N 114.482 -1.236 . . . . 0.0 111.451 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -61.43 -21.67 64.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -83.81 -36.91 23.16 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.795 176.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.86 -31.04 40.41 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 120.904 0.383 . . . . 0.0 110.525 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.38 94.65 0.96 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.208 1.403 . . . . 0.0 109.532 175.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.67 -38.89 15.39 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.921 -176.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -74.76 -10.71 59.77 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.777 -176.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.72 45.63 27.38 Favored Glycine 0 N--CA 1.441 -0.984 0 C-N-CA 120.664 -0.779 . . . . 0.0 111.538 178.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -105.37 -15.94 14.89 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.858 0.837 . . . . 0.0 109.664 -176.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.03 5.04 73.98 Favored Glycine 0 CA--C 1.495 -1.176 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -143.71 125.53 15.16 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -89.21 128.18 41.44 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.274 0 O-C-N 123.556 0.535 . . . . 0.0 110.131 -179.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -91.12 170.97 9.58 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.977 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.61 ' O ' HG12 ' A' ' 142' ' ' VAL . 81.6 t80 -54.34 -44.79 72.41 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -175.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -68.58 -25.53 64.93 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -81.27 -39.1 25.79 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -67.22 -43.03 83.04 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.699 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.61 HG12 ' O ' ' A' ' 138' ' ' TYR . 27.1 m -53.78 -36.52 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -68.83 -42.21 77.5 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.765 -177.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 27.9 ttt -86.5 -30.24 22.13 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.41 -178.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.411 ' SD ' HG21 ' B' ' 89' ' ' ILE . 14.5 tpt . . . . . 0 C--N 1.308 -1.196 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.313 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp . . . . . 0 N--CA 1.449 -0.513 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . 0.404 ' O ' ' HB3' ' B' ' 86' ' ' LYS . 37.1 mt-10 -81.63 -27.43 34.14 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.189 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.8 -50.88 54.51 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.556 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.522 ' O ' HG12 ' B' ' 89' ' ' ILE . 84.5 m95 -63.66 -32.19 73.6 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.487 176.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' B' ' 83' ' ' GLU . 37.8 ttpt -54.09 -58.45 7.27 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 175.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -57.35 -45.54 84.24 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 114.28 -1.327 . . . . 0.0 111.78 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.93 -61.5 2.34 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 124.402 1.064 . . . . 0.0 112.501 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.522 HG12 ' O ' ' B' ' 85' ' ' TRP . 36.7 pt -65.14 -36.26 77.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -174.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -64.33 -55.93 17.91 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . 0.402 ' CG ' ' HB3' ' A' ' 112' ' ' LEU . 3.4 tppp? -68.32 -31.54 71.03 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.645 -174.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.88 -37.34 73.03 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.873 178.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 64.1 tttp . . . . . 0 CA--C 1.55 0.95 0 CA-C-O 121.876 0.846 . . . . 0.0 109.961 177.645 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.7 tp . . . . . 0 N--CA 1.414 -2.238 0 N-CA-C 103.891 -2.633 . . . . 0.0 103.891 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.2 p -68.18 148.02 51.45 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.602 -0.839 . . . . 0.0 109.254 -177.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -61.94 -25.66 67.73 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.0 0.429 . . . . 0.0 110.591 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -64.94 -51.23 62.99 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.034 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -65.52 -35.17 80.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.788 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.521 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 51.5 mt -67.57 -32.31 56.41 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.269 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.125 177.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.59 -40.53 88.94 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 175.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.45 -43.07 97.22 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.063 175.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -73.61 -15.41 61.27 Favored 'General case' 0 C--O 1.169 -3.179 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 68.6 mttm -72.97 -42.99 62.78 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 119.251 0.932 . . . . 0.0 108.636 175.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -62.36 -50.07 73.03 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.51 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.64 -40.74 97.62 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.137 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.44 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 92.8 t80 -60.17 -48.63 80.93 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 123.289 0.636 . . . . 0.0 110.094 178.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 m -69.3 -17.52 63.74 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 123.426 0.453 . . . . 0.0 111.464 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.88 -34.88 78.75 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 174.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.593 ' CD2' HG23 ' A' ' 35' ' ' VAL . 17.1 m-85 -90.31 -44.98 9.34 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.001 177.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -87.27 83.34 7.39 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -71.55 -15.57 62.29 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -170.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.48 ' OD1' ' HB3' ' A' ' 24' ' ' ASP . 4.3 p-10 -97.37 -9.85 26.65 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 118.885 -1.126 . . . . 0.0 110.007 177.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.87 50.58 66.0 Favored Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.403 -0.817 . . . . 0.0 113.373 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.48 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 1.2 p-10 -104.08 -17.3 14.99 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.544 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.54 2.53 50.25 Favored Glycine 0 N--CA 1.436 -1.35 0 C-N-CA 120.022 -1.085 . . . . 0.0 114.513 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 52.9 p -137.31 129.44 29.32 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.606 1.203 . . . . 0.0 109.346 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.1 mt -96.29 122.21 47.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 -174.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -94.84 163.44 13.34 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.039 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 34.1 p -63.55 -30.85 71.91 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.801 0.334 . . . . 0.0 111.5 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -59.93 -46.48 89.25 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.134 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -63.18 -46.87 85.09 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.53 ' O ' ' HE2' ' A' ' 36' ' ' MET . 92.7 mt -54.15 -55.57 26.53 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.21 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.7 -31.56 76.31 Favored Glycine 0 C--N 1.305 -1.165 0 C-N-CA 119.328 -1.415 . . . . 0.0 113.131 -176.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 48.5 m -66.02 -46.73 76.85 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 117.04 0.42 . . . . 0.0 110.569 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.593 HG23 ' CD2' ' A' ' 19' ' ' PHE . 34.1 m -70.02 -37.34 72.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.108 178.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.53 ' HE2' ' O ' ' A' ' 32' ' ' LEU . 1.9 mpp? -64.62 -39.83 94.4 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.528 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.552 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 22.3 ttt180 -66.49 -34.02 76.99 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 121.091 0.472 . . . . 0.0 110.148 178.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.8 m -69.69 -25.68 64.0 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.547 -0.752 . . . . 0.0 109.716 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.6 mt -87.29 -1.62 58.04 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.972 177.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 102.34 -10.0 56.29 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.679 176.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.552 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 60.9 tt0 -95.76 138.85 32.82 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -177.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.41 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -117.95 81.68 16.19 Favored Pre-proline 0 C--N 1.301 -1.543 0 O-C-N 121.609 -0.682 . . . . 0.0 109.822 177.446 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -84.85 149.78 11.05 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 122.293 1.995 . . . . 0.0 111.793 178.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.3 p -90.27 170.28 10.4 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.322 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -55.35 -47.36 75.84 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.447 1.099 . . . . 0.0 110.073 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -45.34 84.13 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.776 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 51' ' ' MET . 42.9 mt-10 -65.61 -44.25 87.09 Favored 'General case' 0 C--O 1.221 -0.431 0 O-C-N 123.655 0.597 . . . . 0.0 111.557 -177.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.9 mt -69.02 -39.27 79.37 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.277 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -71.25 -33.74 70.11 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.89 -36.88 84.8 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.413 0.625 . . . . 0.0 109.394 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.487 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 94.8 mmm -67.51 -47.37 70.19 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.222 177.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 58.5 mt -59.59 -44.12 92.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.18 0.514 . . . . 0.0 110.444 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -55.55 -28.52 55.36 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 114.908 1.448 . . . . 0.0 114.908 -173.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -69.04 -27.24 65.48 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 119.198 -1.001 . . . . 0.0 112.591 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.7 m -101.67 -11.81 8.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.579 0.705 . . . . 0.0 109.794 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -87.92 75.7 8.78 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.423 -173.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.6 -20.57 39.52 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.606 0.717 . . . . 0.0 109.798 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -82.38 -6.96 59.61 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.312 178.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 59.54 43.46 97.57 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 115.895 1.118 . . . . 0.0 115.895 172.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -109.64 -1.33 18.17 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 119.252 -0.979 . . . . 0.0 110.721 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 69.34 23.15 76.48 Favored Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.603 -0.726 . . . . 0.0 113.423 176.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -141.29 149.77 41.68 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 52.3 mt -103.87 114.79 44.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.422 ' HB2' ' HD2' ' A' ' 66' ' ' PRO . 1.2 p30 -78.68 163.25 25.6 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 119.724 -0.791 . . . . 0.0 110.261 174.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.439 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 31.8 t80 -54.21 -50.5 84.3 Favored Pre-proline 0 C--N 1.313 -1.017 0 O-C-N 123.913 0.758 . . . . 0.0 110.879 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.439 ' HD3' ' HB3' ' A' ' 65' ' ' PHE . 59.5 Cg_exo -47.2 -51.58 9.21 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 122.233 1.955 . . . . 0.0 112.739 171.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.08 -47.13 81.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.324 0.583 . . . . 0.0 110.468 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.44 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 37.4 t80 -61.56 -42.99 99.65 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.31 -177.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 90.9 mt -63.61 -44.14 94.83 Favored 'General case' 0 CA--C 1.504 -0.804 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.542 177.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.4 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 36.0 m -59.25 -47.72 84.3 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.778 0.674 . . . . 0.0 109.843 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.2 ttp -60.96 -41.33 96.13 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.428 179.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 21.3 mmt -69.27 -42.45 75.52 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 178.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.31 -39.63 93.63 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.816 0.341 . . . . 0.0 110.303 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 70' ' ' THR . 99.6 mtt180 -61.77 -39.59 92.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.927 175.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -80.63 -3.52 50.76 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 122.228 1.013 . . . . 0.0 110.445 -175.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 51.5 ttm . . . . . 0 C--N 1.305 -1.331 0 CA-C-O 121.798 0.809 . . . . 0.0 108.885 177.602 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 . . . . . 0 CA--C 1.532 0.263 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.481 ' O ' ' HB2' ' A' ' 87' ' ' GLU . 51.2 mm-40 -52.48 -62.42 1.65 Allowed 'General case' 0 C--O 1.202 -1.409 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -179.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -48.16 -45.82 33.92 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.228 1.011 . . . . 0.0 111.464 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 4.5 mm -69.8 -52.42 31.67 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.012 -171.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.4 ttp180 -75.97 -22.27 56.1 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.278 -177.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.481 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 6.4 tp10 -64.6 -52.27 58.4 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 176.05 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.6 -37.91 88.1 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 114.484 -1.235 . . . . 0.0 110.231 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -65.15 -46.56 80.38 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.457 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -69.73 -27.56 65.06 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.646 0.778 . . . . 0.0 112.752 -175.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 13.7 p -72.97 -20.13 18.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 119.464 -0.895 . . . . 0.0 110.438 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -91.5 -60.57 1.85 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 173.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.4 ' CG ' ' H ' ' A' ' 97' ' ' ASN . 14.0 t0 -86.81 82.72 7.73 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 122.689 1.233 . . . . 0.0 109.224 177.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.499 ' HB2' ' HZ2' ' A' ' 94' ' ' LYS . 7.2 mtmp? -78.11 -29.64 49.07 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.949 -174.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -85.68 -13.06 49.68 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-O 121.356 0.598 . . . . 0.0 110.329 -174.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.98 63.34 2.31 Favored Glycine 0 N--CA 1.426 -2.013 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 179.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.4 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 38.5 m-80 -92.33 -19.17 22.41 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.55 13.68 79.7 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -166.62 153.49 9.07 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 124.316 1.046 . . . . 0.0 109.587 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.4 mt -110.94 128.3 67.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 178.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 19.1 m -103.53 160.36 14.8 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.09 -45.01 94.13 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 122.256 0.222 . . . . 0.0 111.338 -178.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.44 -43.8 88.91 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 123.75 0.656 . . . . 0.0 110.302 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -57.76 -56.58 20.09 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.094 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.419 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.0 tm? -58.68 -44.65 90.28 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.295 -1.321 . . . . 0.0 108.995 -173.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.42 ' HB2' HG23 ' A' ' 121' ' ' VAL . 27.8 ttp180 -61.0 -48.74 80.41 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.905 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -60.16 -39.48 86.55 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.472 -178.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.559 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 10.0 p -73.32 -34.3 43.29 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.384 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.488 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.447 ' HG3' HD13 ' A' ' 116' ' ' LEU . 23.1 mmt -63.8 -41.87 97.82 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-N 116.741 -0.209 . . . . 0.0 111.415 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.7 m -62.28 -35.73 79.89 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 176.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -68.81 -33.68 74.25 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.435 0.636 . . . . 0.0 110.381 176.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 52.9 mt -82.86 -16.75 46.4 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.331 -176.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.15 34.86 13.38 Favored Glycine 0 N--CA 1.427 -1.932 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.77 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -103.42 140.69 37.13 Favored 'General case' 0 N--CA 1.418 -2.03 0 C-N-CA 119.722 -0.791 . . . . 0.0 109.795 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -81.43 23.9 0.59 Allowed 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 114.51 -1.223 . . . . 0.0 113.035 -173.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.447 HD13 ' HG3' ' A' ' 109' ' ' MET . 13.9 mt -69.01 132.86 47.32 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 120.605 0.241 . . . . 0.0 110.517 -175.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.8 p -80.43 167.25 20.41 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.018 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -64.47 -28.69 69.84 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 176.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -65.18 -55.11 20.47 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.788 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -55.67 -51.4 67.38 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 123.848 0.717 . . . . 0.0 110.884 -177.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.432 ' O ' HG12 ' A' ' 125' ' ' ILE . 15.2 m -61.22 -37.31 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.354 -177.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -72.51 -44.63 61.95 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.35 0.595 . . . . 0.0 109.709 -178.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.489 ' OE1' ' HD3' ' A' ' 126' ' ' ARG . 4.7 tp10 -67.38 -36.19 80.85 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.253 -176.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.3 mtt -56.13 -54.91 39.4 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.014 174.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.6 mm -57.74 -48.52 83.34 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.81 0 O-C-N 124.226 0.954 . . . . 0.0 110.42 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.489 ' HD3' ' OE1' ' A' ' 123' ' ' GLU . 57.0 ttt180 -59.42 -37.86 79.14 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 123.743 0.817 . . . . 0.0 112.494 -176.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -81.65 -25.14 35.86 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 178.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.88 -28.88 39.89 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 176.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.12 85.35 4.31 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 114.362 -1.29 . . . . 0.0 108.725 173.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 53.9 mt -77.46 -23.9 14.52 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.966 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.35 -176.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -86.5 -10.79 53.36 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 120.503 -0.479 . . . . 0.0 112.197 -175.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.2 41.08 22.64 Favored Glycine 0 C--N 1.317 -0.507 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.474 175.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -101.59 -16.14 16.84 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.73 0.776 . . . . 0.0 109.63 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 96.89 -11.19 66.19 Favored Glycine 0 N--CA 1.441 -0.98 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.471 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -136.36 131.28 34.04 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -178.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 1.5 p -80.73 113.65 20.47 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-O 120.817 0.341 . . . . 0.0 111.761 -177.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -88.46 178.09 6.64 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.498 ' O ' HG13 ' A' ' 142' ' ' VAL . 85.7 t80 -66.76 -39.89 88.04 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -175.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.5 ' O ' HG22 ' A' ' 142' ' ' VAL . 22.5 mm-40 -67.2 -28.82 68.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.321 0.582 . . . . 0.0 110.857 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.11 -33.3 44.48 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.414 0.626 . . . . 0.0 110.367 175.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -75.33 -29.87 60.12 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.831 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 139' ' ' GLU . 31.7 m -60.0 -33.48 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-O 121.247 0.546 . . . . 0.0 110.612 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -71.79 -40.15 69.4 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.729 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 95.9 mmm -69.31 -39.08 78.46 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.172 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 15.5 tpt . . . . . 0 C--N 1.315 -0.93 0 CA-C-O 121.62 0.724 . . . . 0.0 110.317 -179.184 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' B' ' 86' ' ' LYS . 24.8 ttmm . . . . . 0 C--O 1.216 -0.71 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.16 -47.59 79.27 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.75 -58.79 6.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.26 -1.337 . . . . 0.0 111.723 -178.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -67.6 -33.0 74.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' B' ' 82' ' ' LYS . 63.6 tttm -56.13 -57.94 10.03 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 175.116 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -58.44 -40.31 82.23 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.011 -1.45 . . . . 0.0 110.679 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.1 -54.43 44.71 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.803 0.335 . . . . 0.0 111.312 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 80.9 mt -62.78 -38.97 83.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.548 0.69 . . . . 0.0 109.505 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -58.03 -42.91 86.34 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 124.952 1.301 . . . . 0.0 111.548 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -81.0 -42.73 20.7 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.829 -177.085 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.32 -52.34 9.34 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -175.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 18.0 ttpt . . . . . 0 C--N 1.316 -0.851 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -174.37 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.449 ' HB3' HD13 ' A' ' 9' ' ' ILE . 19.6 tp . . . . . 0 N--CA 1.42 -1.929 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.1 p -85.02 145.14 27.85 Favored 'General case' 0 N--CA 1.413 -2.308 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.574 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -51.69 -40.24 59.73 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 125.438 1.495 . . . . 0.0 111.969 -176.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.81 -45.36 89.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.889 -178.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.574 HE21 ' HA ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -65.88 -45.85 80.57 Favored 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 176.997 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.545 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 74.8 mt -57.11 -44.26 82.88 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.352 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.856 -178.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.55 93.6 Favored 'General case' 0 C--O 1.256 1.427 0 CA-C-O 121.393 0.616 . . . . 0.0 111.44 177.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.38 -40.59 96.97 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.664 0.745 . . . . 0.0 109.135 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -73.79 -18.78 60.92 Favored 'General case' 0 C--O 1.189 -2.087 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.509 -178.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.545 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.6 mttt -65.69 -50.78 63.67 Favored 'General case' 0 CA--C 1.504 -0.819 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -45.34 88.4 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.941 177.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.68 87.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.607 179.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -61.99 -45.57 93.06 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 m -68.58 -18.1 64.26 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.957 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -67.18 -41.9 85.12 Favored 'General case' 0 C--O 1.243 0.739 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 172.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.423 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 79.3 m-85 -81.44 -50.94 8.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.872 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -63.41 101.34 0.31 Allowed 'General case' 0 CA--C 1.502 -0.887 0 O-C-N 124.293 0.996 . . . . 0.0 109.038 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 19' ' ' PHE . 41.7 mmtm -71.94 -9.09 57.87 Favored 'General case' 0 N--CA 1.423 -1.8 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.265 -174.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -107.34 -14.35 14.9 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.55 45.09 90.48 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.516 -0.634 . . . . 0.0 111.516 -176.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -112.74 -15.91 12.88 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 122.621 -0.341 . . . . 0.0 111.59 -175.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.82 16.8 20.75 Favored Glycine 0 N--CA 1.43 -1.708 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.111 179.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 68.0 p -142.37 138.67 31.36 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 117.351 0.575 . . . . 0.0 109.804 173.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 67.8 mt -112.99 114.66 47.61 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 176.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 37.2 p -84.41 174.04 10.41 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.162 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.7 p -61.76 -32.83 73.12 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.613 0.721 . . . . 0.0 109.404 174.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -57.56 -55.05 39.9 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 114.639 -1.164 . . . . 0.0 109.051 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -67.23 -39.39 86.2 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.596 -177.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.2 mt -58.38 -50.6 73.1 Favored 'General case' 0 C--O 1.213 -0.821 0 O-C-N 123.133 0.27 . . . . 0.0 111.482 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.09 -30.76 76.24 Favored Glycine 0 C--O 1.214 -1.112 0 C-N-CA 119.488 -1.339 . . . . 0.0 111.836 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.1 m -64.2 -49.45 71.93 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 120.758 0.314 . . . . 0.0 110.456 176.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.1 m -70.22 -37.54 71.75 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.628 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.688 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtt -65.34 -37.74 87.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.73 -0.214 . . . . 0.0 111.09 178.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -63.92 -33.51 75.87 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.932 0.396 . . . . 0.0 110.078 177.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.8 m -71.01 -30.0 66.11 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.482 177.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -84.64 -19.19 33.3 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 110.29 35.74 2.07 Favored Glycine 0 N--CA 1.442 -0.911 0 C-N-CA 120.978 -0.629 . . . . 0.0 114.475 177.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.551 ' HB2' ' NE2' ' B' ' 90' ' ' GLN . 61.3 tt0 -140.06 132.16 27.98 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 171.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.405 HD21 ' N ' ' A' ' 42' ' ' ASN . 0.7 OUTLIER -116.49 83.81 13.97 Favored Pre-proline 0 C--N 1.289 -2.052 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 175.533 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.401 ' HG2' HD22 ' A' ' 48' ' ' LEU . 9.3 Cg_endo -86.96 156.64 8.59 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.583 2.189 . . . . 0.0 112.415 -179.066 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.3 t -82.45 158.29 23.3 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mp0 -59.6 -28.87 67.55 Favored 'General case' 0 C--O 1.21 -1.001 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -43.22 82.86 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.063 0.459 . . . . 0.0 110.696 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -69.21 -44.01 72.95 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.814 0.816 . . . . 0.0 109.456 -178.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.401 HD22 ' HG2' ' A' ' 43' ' ' PRO . 87.8 mt -63.72 -40.49 96.88 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.32 -178.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -64.33 -37.85 88.96 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.168 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -59.21 -42.43 90.95 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 123.708 0.63 . . . . 0.0 109.981 179.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.2 tpp -68.36 -52.99 27.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.949 177.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.1 mt -54.76 -49.15 71.06 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.749 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.629 -178.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -58.76 -20.75 52.4 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 123.953 0.901 . . . . 0.0 113.132 -172.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -73.74 -43.02 60.29 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-O 121.214 0.53 . . . . 0.0 110.068 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.442 HG13 ' HB2' ' A' ' 71' ' ' MET . 26.6 m -90.72 -15.41 8.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.896 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -81.57 88.78 6.18 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.681 -178.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.79 -13.16 45.94 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -91.19 -10.33 42.09 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -178.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 74.15 29.02 63.12 Favored Glycine 0 N--CA 1.439 -1.106 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.512 177.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -96.35 -16.48 21.27 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 117.607 0.704 . . . . 0.0 111.784 177.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.69 23.34 64.79 Favored Glycine 0 N--CA 1.441 -1.013 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.7 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 15.2 p -138.42 137.24 37.04 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' A' ' 26' ' ' THR . 54.3 mt -89.61 110.37 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.963 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -175.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -79.89 162.6 24.91 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.486 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 68.3 t80 -52.84 -53.02 59.34 Favored Pre-proline 0 C--N 1.307 -1.252 0 CA-C-O 119.061 -0.495 . . . . 0.0 112.155 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -50.99 -42.23 53.28 Favored 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 122.679 2.253 . . . . 0.0 112.715 174.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -68.48 -35.88 78.17 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.265 0.555 . . . . 0.0 110.287 -179.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -66.29 -39.87 89.67 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 85.8 mt -63.21 -44.12 96.19 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.596 176.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 57.4 m -55.14 -50.18 69.91 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 123.676 0.61 . . . . 0.0 109.809 176.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.442 ' HB2' HG13 ' A' ' 55' ' ' VAL . 31.5 ttp -59.46 -45.32 91.95 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.603 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 31.8 tpp -67.62 -39.88 84.7 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.27 0.557 . . . . 0.0 110.842 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.11 -24.81 61.54 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.36 -178.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -75.63 -31.73 59.97 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.775 0.798 . . . . 0.0 108.947 172.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -74.46 -54.25 7.93 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.335 -174.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 20.9 ptp . . . . . 0 C--N 1.316 -0.871 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.257 -176.933 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 . . . . . 0 CA--C 1.496 -1.133 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -50.86 -37.41 43.2 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.449 ' CD ' ' HZ3' ' B' ' 93' ' ' LYS . 14.6 mm-40 -62.16 -46.03 90.76 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.488 0.661 . . . . 0.0 111.49 175.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.447 HG23 HG13 ' A' ' 142' ' ' VAL . 10.0 mm -70.61 -42.44 77.97 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.556 -176.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -69.34 -34.47 74.67 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.517 -1.22 . . . . 0.0 111.562 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.35 -48.62 79.0 Favored 'General case' 0 CA--C 1.495 -1.171 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.472 ' O ' ' HD2' ' A' ' 92' ' ' PHE . . . -61.0 -44.85 96.81 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 113.238 -1.801 . . . . 0.0 110.701 177.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -63.06 -47.31 83.5 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.086 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -58.17 -35.05 71.0 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 178.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.444 HG11 ' O ' ' A' ' 88' ' ' ALA . 7.9 p -76.59 -28.28 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.278 -178.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.472 ' HD2' ' O ' ' A' ' 88' ' ' ALA . 73.8 m-85 -86.63 -42.29 13.56 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.885 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -73.59 85.56 1.59 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.941 0.877 . . . . 0.0 109.411 177.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -79.44 -42.7 24.81 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.952 -175.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.22 -13.03 51.2 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.859 -175.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.05 54.57 4.07 Favored Glycine 0 C--N 1.307 -1.075 0 C-N-CA 120.149 -1.024 . . . . 0.0 110.558 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -100.22 -19.96 16.15 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.06 2.03 88.36 Favored Glycine 0 C--O 1.24 0.499 0 N-CA-C 110.24 -1.144 . . . . 0.0 110.24 -177.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.439 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 42.4 m-85 -142.22 130.75 22.53 Favored 'General case' 0 N--CA 1.425 -1.686 0 C-N-CA 126.262 1.825 . . . . 0.0 106.38 -178.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 3.0 mt -81.19 126.98 39.91 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.6 t -94.33 150.54 20.18 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.68 -44.88 80.61 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.631 0.253 . . . . 0.0 111.136 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.27 -34.87 78.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.414 0.626 . . . . 0.0 109.643 178.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -67.17 -45.97 75.39 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.057 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.411 ' O ' HG12 ' A' ' 108' ' ' VAL . 3.9 tt -63.6 -40.0 95.82 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 179.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? -61.66 -39.84 92.8 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -58.32 -49.75 76.08 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.629 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.475 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.9 p -68.06 -30.16 47.13 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.667 0 C-N-CA 120.327 -0.549 . . . . 0.0 109.795 -179.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.8 mmt -63.96 -42.25 97.34 Favored 'General case' 0 CA--C 1.491 -1.299 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.7 m -66.4 -32.44 73.82 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -73.56 -29.01 62.16 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.652 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 79.5 mt -91.2 -9.8 44.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.388 0.613 . . . . 0.0 110.165 -178.049 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 75.9 20.37 77.92 Favored Glycine 0 N--CA 1.435 -1.405 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.363 179.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -76.56 -27.53 55.93 Favored 'General case' 0 CA--C 1.495 -1.156 0 CA-C-N 116.98 0.39 . . . . 0.0 110.951 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 59.96 42.64 15.79 Favored 'General case' 0 C--O 1.236 0.362 0 O-C-N 124.32 1.013 . . . . 0.0 111.689 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 58.5 mt -86.27 154.8 21.0 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.487 ' H ' ' CD ' ' A' ' 120' ' ' GLU . 20.7 p -101.78 177.31 4.94 Favored 'General case' 0 N--CA 1.426 -1.626 0 C-N-CA 119.061 -1.056 . . . . 0.0 110.743 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -65.21 -18.55 65.4 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.145 0.498 . . . . 0.0 110.853 -177.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -70.69 -57.05 5.09 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.472 -177.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.487 ' CD ' ' H ' ' A' ' 117' ' ' THR . 3.5 pm0 -70.08 -35.52 74.25 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.336 -177.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.469 ' O ' HG12 ' A' ' 125' ' ' ILE . 5.9 m -70.93 -26.56 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.42 -178.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -72.82 -35.64 67.34 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -67.48 -36.0 80.27 Favored 'General case' 0 C--N 1.352 0.704 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 176.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.416 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 65.2 mtt -55.15 -46.56 75.71 Favored 'General case' 0 CA--C 1.509 -0.608 0 O-C-N 124.145 0.903 . . . . 0.0 109.933 176.271 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 121' ' ' VAL . 51.2 mm -66.32 -53.99 30.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.258 177.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -45.82 -59.66 2.67 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 126.274 1.83 . . . . 0.0 114.555 -174.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -69.44 -20.08 63.77 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.921 0.391 . . . . 0.0 111.64 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -92.31 -21.26 20.38 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.636 0.732 . . . . 0.0 110.154 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -79.6 73.26 6.3 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 122.323 1.059 . . . . 0.0 110.282 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 27.9 mt -82.98 -9.71 11.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 CA-C-N 114.605 -1.18 . . . . 0.0 108.757 176.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -84.8 -11.84 54.9 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.46 0.648 . . . . 0.0 109.537 -178.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 65.7 36.26 92.11 Favored Glycine 0 N--CA 1.436 -1.313 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.453 177.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -101.29 -16.38 16.96 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.329 0.585 . . . . 0.0 110.289 -176.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.15 0.25 68.19 Favored Glycine 0 C--N 1.312 -0.796 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -176.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.439 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 21.3 mt-30 -144.36 138.91 28.15 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 1.3 p -83.45 118.98 31.93 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -176.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.424 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 37.7 t30 -73.8 156.3 37.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.788 1.235 . . . . 0.0 110.489 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.459 ' O ' HG12 ' A' ' 142' ' ' VAL . 80.2 t80 -56.81 -48.79 77.18 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 122.738 0.415 . . . . 0.0 111.725 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.461 ' O ' HG22 ' A' ' 142' ' ' VAL . 27.0 mm-40 -65.98 -33.93 76.94 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.994 0.426 . . . . 0.0 111.971 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -71.67 -34.5 69.76 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 121.219 0.533 . . . . 0.0 110.157 175.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -68.34 -42.46 79.24 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.81 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 139' ' ' GLU . 8.9 m -63.58 -36.61 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 120.283 -0.567 . . . . 0.0 109.646 178.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -64.7 -49.5 70.64 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.712 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -69.41 -44.61 71.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.515 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.7 tpt . . . . . 0 C--N 1.321 -0.64 0 N-CA-C 111.455 0.169 . . . . 0.0 111.455 -177.627 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt . . . . . 0 C--O 1.216 -0.665 0 CA-C-O 120.335 0.112 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -61.96 -35.72 79.31 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 123.099 0.559 . . . . 0.0 110.273 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.25 -55.83 28.95 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.474 179.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.552 ' O ' HG12 ' B' ' 89' ' ' ILE . 35.9 m95 -67.43 -37.56 83.21 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 177.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -54.37 -56.78 15.17 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -63.14 -27.83 69.64 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.259 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.36 -55.16 8.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.618 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.552 HG12 ' O ' ' B' ' 85' ' ' TRP . 44.7 mm -57.38 -50.53 76.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.831 0.824 . . . . 0.0 109.188 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . 0.551 ' NE2' ' HB2' ' A' ' 41' ' ' GLN . 29.9 tt0 -61.51 -43.29 99.13 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 113.949 -1.478 . . . . 0.0 112.278 -176.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -76.15 -31.46 58.58 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.325 -0.55 . . . . 0.0 111.337 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.09 -38.08 89.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.545 0.688 . . . . 0.0 109.621 177.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.449 ' HZ3' ' CD ' ' A' ' 84' ' ' GLU . 38.0 mttm . . . . . 0 C--N 1.315 -0.905 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.599 175.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.445 ' HB3' HD13 ' A' ' 9' ' ' ILE . 20.1 tp . . . . . 0 N--CA 1.416 -2.132 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.1 p -77.31 151.03 35.19 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.585 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -59.09 -36.1 74.55 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -176.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -58.85 -52.83 64.06 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 121.261 0.553 . . . . 0.0 109.72 177.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -62.58 -46.69 87.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.032 -177.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.509 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 75.2 mt -60.0 -36.71 68.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 O-C-N 123.588 0.555 . . . . 0.0 111.084 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.19 -44.93 86.83 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-O 120.647 0.26 . . . . 0.0 110.527 177.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -61.57 -36.63 81.19 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.717 176.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.451 ' CZ ' ' HG2' ' A' ' 72' ' ' MET . 56.0 m-85 -72.32 -33.94 67.71 Favored 'General case' 0 C--O 1.185 -2.323 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 177.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.509 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 99.2 mttt -59.03 -42.99 91.54 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.756 0.788 . . . . 0.0 109.794 176.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.34 -54.46 40.17 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.592 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.9 -31.44 69.23 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.042 -176.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.4 ' CD2' ' HD2' ' A' ' 65' ' ' PHE . 63.1 t80 -63.11 -48.25 79.33 Favored 'General case' 0 C--O 1.206 -1.237 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 177.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -68.84 -17.33 63.98 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.251 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.6 tp -72.0 -31.8 66.58 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.414 0.626 . . . . 0.0 110.04 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.455 ' CD2' HG22 ' A' ' 35' ' ' VAL . 10.5 m-85 -95.75 -35.86 11.39 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.114 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -77.64 99.38 5.77 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 175.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.69 -21.89 66.85 Favored 'General case' 0 C--N 1.307 -1.251 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -173.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.436 ' OD2' ' HB3' ' A' ' 24' ' ' ASP . 7.5 p-10 -113.12 -13.32 13.04 Favored 'General case' 0 C--N 1.305 -1.353 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.517 179.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.33 57.01 7.89 Favored Glycine 0 C--O 1.242 0.62 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.686 176.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.436 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 2.9 p-10 -112.91 -13.93 13.09 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 120.956 0.407 . . . . 0.0 110.518 -177.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.28 6.95 44.17 Favored Glycine 0 N--CA 1.433 -1.545 0 C-N-CA 121.172 -0.537 . . . . 0.0 112.79 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.423 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 74.6 p -137.78 131.27 30.97 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 117.288 0.544 . . . . 0.0 109.68 175.005 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.3 mt -102.26 124.99 56.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.993 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 177.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 27.0 p -94.3 167.7 11.37 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.294 178.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 40.0 p -64.82 -26.36 68.31 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 120.901 0.381 . . . . 0.0 110.238 177.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -55.32 -60.65 3.11 Favored 'General case' 0 C--O 1.242 0.668 0 C-N-CA 124.16 0.984 . . . . 0.0 108.941 174.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.88 -42.95 98.94 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 113.986 -1.461 . . . . 0.0 109.873 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.631 ' O ' ' HE2' ' A' ' 36' ' ' MET . 74.9 mt -56.43 -61.73 2.21 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.878 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.17 -31.84 82.11 Favored Glycine 0 C--N 1.309 -0.969 0 C-N-CA 119.303 -1.427 . . . . 0.0 113.43 -174.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.6 m -67.59 -44.46 78.06 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 116.864 0.332 . . . . 0.0 111.068 178.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.503 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 31.3 m -71.48 -35.98 58.84 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 C-N-CA 119.699 -0.801 . . . . 0.0 110.152 178.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.631 ' HE2' ' O ' ' A' ' 32' ' ' LEU . 1.5 mpp? -64.11 -44.4 92.38 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.866 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -64.69 -33.42 75.9 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.86 0.362 . . . . 0.0 110.198 178.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 m -70.77 -21.46 62.5 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.091 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 92.2 mt -88.98 -22.77 22.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.71 0.291 . . . . 0.0 110.45 177.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.89 3.44 31.93 Favored Glycine 0 C--N 1.314 -0.693 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.728 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.43 ' C ' HD21 ' A' ' 42' ' ' ASN . 10.2 tp60 -101.47 131.47 47.58 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.43 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.47 79.87 37.84 Favored Pre-proline 0 C--N 1.298 -1.658 0 C-N-CA 119.709 -0.796 . . . . 0.0 112.704 177.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -78.81 153.97 26.2 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 121.703 1.602 . . . . 0.0 108.675 169.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.41 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 47.6 p -81.85 173.33 12.36 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.134 -178.02 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -59.12 -40.76 86.42 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 123.827 0.851 . . . . 0.0 110.658 -176.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.43 -35.87 68.43 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.248 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.41 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 23.0 mm-40 -60.51 -47.97 83.8 Favored 'General case' 0 C--O 1.241 0.607 0 O-C-N 123.502 0.501 . . . . 0.0 110.943 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.445 ' O ' HG13 ' A' ' 52' ' ' ILE . 78.9 mt -62.43 -41.06 98.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.129 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -67.52 -36.57 81.29 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.548 -177.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -67.57 -42.03 83.23 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.013 0.435 . . . . 0.0 109.983 178.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.5 tpp -60.06 -36.8 78.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.97 -1.013 . . . . 0.0 109.653 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 48' ' ' LEU . 49.0 mt -65.84 -50.21 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.143 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.4 175.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -60.98 -23.39 65.32 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -174.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.68 -44.4 73.32 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 123.98 0.912 . . . . 0.0 109.238 175.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.8 m -105.6 -15.49 8.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -177.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -72.17 103.8 3.44 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.062 0.458 . . . . 0.0 111.581 -176.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.07 -21.61 25.95 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.325 -179.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.05 -12.08 57.48 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.277 -174.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 62.8 29.84 75.22 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -173.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -100.12 -8.98 23.05 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.199 0.523 . . . . 0.0 110.853 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 86.82 12.83 68.07 Favored Glycine 0 N--CA 1.432 -1.602 0 CA-C-N 115.856 -0.611 . . . . 0.0 114.018 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.423 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 53.9 p -132.35 150.86 52.07 Favored 'General case' 0 C--O 1.255 1.363 0 CA-C-N 117.919 0.859 . . . . 0.0 111.124 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 86.1 mt -91.76 112.35 25.45 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.719 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -80.28 153.11 28.68 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 175.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.435 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 31.2 t80 -53.03 -50.15 83.51 Favored Pre-proline 0 CA--C 1.553 1.096 0 O-C-N 123.429 0.456 . . . . 0.0 111.93 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.435 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.1 Cg_endo -49.72 -47.55 22.62 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.653 2.235 . . . . 0.0 112.872 173.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -62.74 -41.42 99.17 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 121.786 0.803 . . . . 0.0 110.425 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -61.43 -43.97 97.95 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.382 176.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.6 mt -62.91 -35.11 78.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.937 178.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.9 m -58.68 -53.54 57.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 122.617 0.367 . . . . 0.0 111.191 178.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -64.97 -31.55 72.84 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.856 -177.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.451 ' HG2' ' CZ ' ' A' ' 12' ' ' PHE . 13.1 tpp -79.21 -38.75 34.95 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 119.66 -0.816 . . . . 0.0 110.978 -176.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.75 -24.31 62.59 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-O 120.682 0.277 . . . . 0.0 110.942 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -72.34 -27.34 62.35 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 121.244 0.545 . . . . 0.0 110.289 174.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.6 tttp -78.68 -47.76 16.34 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 176.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 65.6 mtp . . . . . 0 C--N 1.304 -1.377 0 CA-C-N 113.976 -1.465 . . . . 0.0 110.927 -177.162 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 N--CA 1.439 -1.018 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 47.5 mt-10 -53.59 -63.4 1.16 Allowed 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -170.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -83.95 -21.65 31.73 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 121.739 0.78 . . . . 0.0 109.589 -176.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.4 mm -66.75 -47.33 83.26 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.407 -172.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -73.28 -30.5 63.45 Favored 'General case' 0 N--CA 1.423 -1.82 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.45 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 39.4 mt-10 -64.63 -46.22 83.48 Favored 'General case' 0 C--O 1.247 0.938 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.115 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.455 ' O ' HG11 ' A' ' 91' ' ' VAL . . . -67.68 -42.51 81.99 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.274 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -60.06 -45.63 92.24 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 178.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -60.85 -31.08 70.53 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.649 0.78 . . . . 0.0 112.465 -179.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.455 HG11 ' O ' ' A' ' 88' ' ' ALA . 14.5 p -79.52 -27.27 12.78 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 C-N-CA 119.173 -1.011 . . . . 0.0 111.63 -179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -82.14 -52.53 6.9 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -87.84 81.47 7.56 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 122.558 1.17 . . . . 0.0 108.159 175.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -76.09 -29.71 58.04 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 113.24 -1.8 . . . . 0.0 110.575 -174.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -73.97 -13.79 60.93 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.198 0.523 . . . . 0.0 110.72 178.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 66.24 42.83 93.98 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.981 -0.554 . . . . 0.0 113.491 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -98.56 -10.7 23.05 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 122.576 -0.367 . . . . 0.0 111.91 -179.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 102.19 4.45 50.55 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.357 -0.925 . . . . 0.0 113.24 174.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -151.99 132.42 13.78 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-O 121.168 0.509 . . . . 0.0 111.266 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.1 mt -79.11 128.59 38.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 -177.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.6 t -113.61 145.32 41.45 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 176.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.49 -50.45 62.71 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -173.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.36 -44.08 84.06 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 123.278 0.361 . . . . 0.0 111.86 -177.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -71.89 -37.74 70.08 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.992 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.477 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.1 tt -60.59 -43.5 97.3 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 178.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -64.41 -45.53 87.21 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 23.2 t-80 -59.2 -46.95 87.08 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.391 -178.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.547 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.2 p -66.38 -36.69 77.95 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.131 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.724 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.5 mmt -59.88 -42.27 93.4 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-O 120.699 0.285 . . . . 0.0 111.552 178.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 16.4 m -62.07 -35.42 78.6 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.633 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -74.39 -32.38 62.69 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.371 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 60.9 mt -84.9 -20.14 31.21 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.722 -174.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.68 35.61 6.8 Favored Glycine 0 N--CA 1.423 -2.179 0 C-N-CA 119.773 -1.204 . . . . 0.0 111.792 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.542 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 11.0 tp10 -120.19 111.98 18.51 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 176.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -80.28 94.36 6.08 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.767 -178.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.423 HD23 ' HG3' ' A' ' 114' ' ' GLU . 15.0 mt -119.89 132.3 55.51 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 105.735 -1.95 . . . . 0.0 105.735 176.033 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.4 p -94.27 -176.86 4.09 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 118.552 -1.259 . . . . 0.0 109.783 178.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -56.46 -42.07 77.57 Favored 'General case' 0 C--O 1.208 -1.098 0 C-N-CA 123.374 0.67 . . . . 0.0 111.585 -175.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -69.62 -24.7 63.69 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 113.399 0.888 . . . . 0.0 113.399 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -79.43 -46.91 16.63 Favored 'General case' 0 CA--C 1.499 -0.998 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.585 175.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 125' ' ' ILE . 13.9 m -65.67 -34.85 73.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.92 -43.13 99.64 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 123.516 0.726 . . . . 0.0 110.453 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -65.98 -40.93 91.65 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.401 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 64.2 mtt -60.87 -41.05 95.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.235 178.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.473 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.0 mm -65.26 -53.03 45.14 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.804 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -56.32 -40.7 74.82 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.359 0.664 . . . . 0.0 112.426 -175.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -79.57 -8.17 58.99 Favored 'General case' 0 C--N 1.309 -1.189 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -108.76 -22.58 12.16 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-O 121.3 0.572 . . . . 0.0 110.294 177.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -71.64 95.92 1.51 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 125.087 1.355 . . . . 0.0 109.479 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 63.3 mt -83.74 -48.69 17.05 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.167 -177.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -86.13 -11.3 53.0 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -172.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 84.7 66.87 1.44 Allowed Glycine 0 C--N 1.296 -1.647 0 C-N-CA 120.233 -0.984 . . . . 0.0 112.837 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -112.19 -16.35 13.02 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 177.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.06 5.41 67.92 Favored Glycine 0 CA--C 1.506 -0.516 0 N-CA-C 109.191 -1.563 . . . . 0.0 109.191 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -151.22 151.25 31.61 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.883 1.673 . . . . 0.0 106.868 -176.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -104.28 116.2 47.63 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.971 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -176.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -78.49 161.09 27.32 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.528 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.422 ' O ' HG13 ' A' ' 142' ' ' VAL . 81.8 t80 -55.58 -45.24 77.41 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 123.165 0.586 . . . . 0.0 112.045 -177.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.41 ' O ' HG23 ' A' ' 142' ' ' VAL . 38.2 mm-40 -66.91 -21.47 65.99 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -84.32 -38.09 20.81 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 175.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -74.5 -25.03 59.1 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.681 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.422 HG13 ' O ' ' A' ' 138' ' ' TYR . 35.1 m -56.42 -27.94 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-O 121.116 0.484 . . . . 0.0 110.623 176.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -78.11 -64.3 1.19 Allowed 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 176.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 16.2 tpt -57.36 -28.72 63.41 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -171.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.317 -0.828 0 CA-C-O 121.324 0.583 . . . . 0.0 110.028 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 59.6 tttm . . . . . 0 N--CA 1.445 -0.685 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -71.34 -27.26 63.25 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.601 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.53 -53.45 54.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.965 179.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.401 ' CZ2' ' HB3' ' A' ' 124' ' ' MET . 32.2 m95 -67.36 -35.61 79.71 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 177.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -52.41 -55.37 22.23 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.181 0.925 . . . . 0.0 108.636 177.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -68.17 -38.56 82.21 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-N 114.129 -1.396 . . . . 0.0 112.581 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.35 -50.41 71.58 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -176.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 27.3 pt -72.9 -19.72 18.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.516 0.674 . . . . 0.0 112.456 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -79.16 -49.67 12.21 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-O 121.981 0.896 . . . . 0.0 109.535 175.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 91' ' ' LYS . . . . . 0.542 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 18.5 tptm -71.39 -53.97 12.28 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 125.939 1.696 . . . . 0.0 113.596 -175.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . 0.511 ' HA ' HD13 ' A' ' 112' ' ' LEU . . . -54.27 -51.92 63.02 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -169.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? . . . . . 0 N--CA 1.417 -2.105 0 O-C-N 122.13 -0.356 . . . . 0.0 111.378 -177.072 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.588 0 CA-C-O 120.517 0.199 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -125.46 15.87 8.25 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 121.565 -0.709 . . . . 0.0 109.914 -177.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.579 ' O ' HD11 ' A' ' 4' ' ' LEU . 15.8 pt20 -77.59 124.28 27.72 Favored 'General case' 0 CA--C 1.457 -2.613 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -174.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.579 HD11 ' O ' ' A' ' 3' ' ' GLN . 2.8 mm? -132.79 152.36 51.81 Favored 'General case' 0 N--CA 1.395 -3.203 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.225 168.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.46 ' O ' HG13 ' A' ' 9' ' ' ILE . 27.0 p -88.1 170.09 11.37 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 174.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -64.93 -43.82 91.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -174.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -64.89 -36.56 84.74 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.838 0.827 . . . . 0.0 108.987 178.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.414 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 6.0 tp-100 -62.39 -50.27 72.21 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.349 -1.296 . . . . 0.0 108.983 178.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 5' ' ' THR . 82.5 mt -59.14 -39.7 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.571 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.5 -34.66 77.3 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.151 0.501 . . . . 0.0 111.466 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -74.42 -36.59 63.44 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.414 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 23.7 m-85 -69.19 -31.59 70.31 Favored 'General case' 0 C--O 1.2 -1.509 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.861 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -55.43 -48.18 74.83 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 172.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.425 ' O ' HD13 ' A' ' 18' ' ' LEU . 40.8 tt0 -60.81 -58.86 6.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.37 178.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.34 -48.34 62.45 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.381 0.672 . . . . 0.0 111.117 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.429 ' HZ ' ' O ' ' A' ' 25' ' ' GLY . 64.2 t80 -56.1 -44.88 79.48 Favored 'General case' 0 C--O 1.213 -0.816 0 C-N-CA 124.312 1.045 . . . . 0.0 110.892 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.4 m -73.47 -27.44 61.4 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.723 -177.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.425 HD13 ' O ' ' A' ' 14' ' ' GLU . 8.6 mp -66.62 -34.07 77.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.009 0.433 . . . . 0.0 111.564 176.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -87.74 -36.59 17.26 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.901 176.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -76.85 87.98 3.44 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-O 122.12 0.962 . . . . 0.0 109.931 176.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.491 ' HE3' ' CG2' ' A' ' 34' ' ' THR . 61.5 mttm -68.66 -28.36 66.81 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.574 -1.193 . . . . 0.0 112.655 -175.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.532 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 23.9 m-20 -82.84 -14.12 54.92 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.541 -0.864 . . . . 0.0 110.539 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.85 44.42 97.09 Favored Glycine 0 CA--C 1.517 0.205 0 O-C-N 123.353 0.408 . . . . 0.0 112.082 -178.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.532 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 4.6 p30 -113.18 -16.45 12.57 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 120.797 0.332 . . . . 0.0 111.018 -176.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.429 ' O ' ' HZ ' ' A' ' 16' ' ' PHE . . . 102.32 4.42 50.17 Favored Glycine 0 N--CA 1.431 -1.646 0 C-N-CA 120.014 -1.088 . . . . 0.0 114.666 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.9 p -138.63 130.77 28.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 118.33 1.065 . . . . 0.0 110.769 172.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 56.6 mt -93.1 128.68 44.43 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 C-N-CA 122.371 0.269 . . . . 0.0 110.368 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 p -101.47 171.51 7.53 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 123.635 0.774 . . . . 0.0 110.149 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 47.1 p -69.19 -24.84 64.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.273 0.559 . . . . 0.0 109.907 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -57.63 -53.08 62.2 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.236 175.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -67.66 -42.8 81.59 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 114.124 -1.398 . . . . 0.0 110.723 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.1 mt -59.67 -54.19 49.25 Favored 'General case' 0 C--O 1.204 -1.303 0 O-C-N 123.767 0.667 . . . . 0.0 110.314 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.91 -27.99 69.54 Favored Glycine 0 C--N 1.313 -0.741 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.035 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.491 ' CG2' ' HE3' ' A' ' 21' ' ' LYS . 58.0 m -75.6 -43.15 49.61 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 116.941 0.371 . . . . 0.0 110.804 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 31.5 m -68.5 -33.98 63.0 Favored 'Isoleucine or valine' 0 C--N 1.344 0.34 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.487 178.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -65.5 -40.63 93.25 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.262 173.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -59.8 -48.07 83.15 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 123.137 0.575 . . . . 0.0 110.072 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.3 m -69.51 -21.1 63.7 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.305 0.574 . . . . 0.0 111.041 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.551 HD13 ' O ' ' A' ' 112' ' ' LEU . 3.4 tm? -83.05 -23.2 33.27 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.73 39.71 3.09 Favored Glycine 0 N--CA 1.433 -1.521 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.512 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.443 ' C ' HD21 ' A' ' 42' ' ' ASN . 35.6 tt0 -143.96 135.58 26.05 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 177.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.443 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.76 84.36 43.56 Favored Pre-proline 0 C--N 1.301 -1.515 0 O-C-N 122.167 -0.333 . . . . 0.0 110.193 176.255 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -76.83 170.87 19.02 Favored 'Trans proline' 0 C--O 1.242 0.721 0 C-N-CA 122.475 2.117 . . . . 0.0 110.163 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.51 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 77.0 p -89.42 164.38 14.88 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.904 -177.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -57.17 -41.66 79.67 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 124.356 1.062 . . . . 0.0 108.45 176.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.92 -42.35 98.98 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.094 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.51 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 7.8 mm-40 -62.92 -47.57 82.69 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 121.211 0.529 . . . . 0.0 110.965 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.4 mt -69.7 -38.12 76.84 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.503 -176.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -64.45 -45.57 86.88 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -61.47 -44.14 97.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.404 177.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 51.3 tpp -55.63 -44.09 76.79 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.016 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.7 mt -65.02 -56.26 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.569 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -58.92 -23.7 61.57 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -172.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -66.5 -38.77 87.97 Favored 'General case' 0 N--CA 1.386 -3.663 0 C-N-CA 123.122 0.569 . . . . 0.0 111.679 175.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.588 HG13 ' SD ' ' A' ' 71' ' ' MET . 8.6 m -95.87 -18.79 6.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 120.838 0.351 . . . . 0.0 110.454 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -70.62 89.84 0.74 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.67 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.37 -27.11 23.0 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.207 -176.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -82.23 -11.71 58.51 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.384 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.08 17.98 79.69 Favored Glycine 0 N--CA 1.434 -1.451 0 CA-C-O 119.457 -0.635 . . . . 0.0 114.228 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.0 p30 -81.39 -16.31 52.59 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.043 1.421 . . . . 0.0 111.871 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.78 4.71 58.94 Favored Glycine 0 N--CA 1.441 -0.968 0 C-N-CA 120.545 -0.836 . . . . 0.0 114.027 177.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.0 p -135.78 166.77 22.52 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 117.909 0.855 . . . . 0.0 111.198 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.3 mt -91.27 111.62 24.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -89.66 161.4 16.13 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 176.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.447 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 37.1 t80 -58.5 -50.11 89.85 Favored Pre-proline 0 CA--C 1.553 1.086 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.5 Cg_endo -49.23 -41.92 41.06 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.853 2.368 . . . . 0.0 112.479 174.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -70.64 -41.06 72.67 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.517 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.678 ' CZ ' ' HA ' ' B' ' 100' ' ' ALA . 1.4 t80 -59.23 -45.0 92.31 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.729 174.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.51 -45.7 80.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.338 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.518 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 43.5 m -57.35 -54.32 48.18 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 123.618 0.574 . . . . 0.0 110.816 174.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.588 ' SD ' HG13 ' A' ' 55' ' ' VAL . 35.6 ttp -53.69 -51.72 62.32 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 123.737 0.815 . . . . 0.0 112.035 -178.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 34.2 tpp -67.74 -43.27 80.31 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.65 -28.88 69.7 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 123.726 0.641 . . . . 0.0 111.54 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.518 ' HG3' ' O ' ' A' ' 70' ' ' THR . 51.6 mtp180 -79.21 -36.39 40.23 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.177 177.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.403 ' HZ1' ' CG ' ' B' ' 97' ' ' ASP . 59.5 mtpt -72.79 -30.66 64.27 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 121.465 0.65 . . . . 0.0 110.809 -178.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.431 ' HG3' ' HD2' ' A' ' 148' ' ' LYS . 56.6 ttp -84.14 -16.31 44.02 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.684 -176.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -142.16 -74.63 0.3 Allowed 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 119.688 -0.805 . . . . 0.0 112.216 -175.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -153.86 142.33 20.71 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 117.67 0.214 . . . . 0.0 110.459 -178.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.51 -29.55 41.58 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 168.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.0 t70 176.65 -55.06 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 112.465 -2.152 . . . . 0.0 106.307 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.4 p -108.44 -173.32 2.25 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 113.68 -1.6 . . . . 0.0 110.54 -177.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -76.51 11.9 1.45 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.946 0.899 . . . . 0.0 112.66 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -51.36 -50.71 58.97 Favored 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.333 0.653 . . . . 0.0 111.778 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 74' ' ' ARG . 8.2 mm-40 -60.03 -35.32 74.84 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.46 -176.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 30.3 mm -74.97 -45.04 43.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.732 -177.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -71.48 -35.86 70.96 Favored 'General case' 0 C--O 1.21 -1.021 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.401 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.402 ' CD ' HH21 ' A' ' 90' ' ' ARG . 5.6 mm-40 -61.91 -35.89 79.7 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.637 0.256 . . . . 0.0 111.597 175.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.445 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -68.64 -44.3 74.46 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 176.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -59.9 -41.67 92.17 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 121.317 0.579 . . . . 0.0 109.533 178.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.402 HH21 ' CD ' ' A' ' 87' ' ' GLU . 7.0 tmm_? -61.7 -36.82 82.0 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 125.356 1.462 . . . . 0.0 111.822 -178.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 88' ' ' ALA . 9.6 p -80.43 -19.01 12.05 Favored 'Isoleucine or valine' 0 C--O 1.248 0.982 0 CA-C-O 121.589 0.709 . . . . 0.0 111.066 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -88.06 -54.3 4.29 Favored 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 120.025 -0.67 . . . . 0.0 111.467 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -104.07 87.57 2.8 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.049 0.452 . . . . 0.0 110.373 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HD3' ' N ' ' A' ' 94' ' ' LYS . 3.3 mppt? -80.11 -28.13 39.06 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.525 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -77.44 -13.24 59.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.127 -171.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.7 62.46 3.01 Favored Glycine 0 N--CA 1.431 -1.645 0 C-N-CA 120.091 -1.052 . . . . 0.0 111.542 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -96.7 -18.64 19.53 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 176.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.86 -5.01 85.9 Favored Glycine 0 N--CA 1.441 -1.0 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.486 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 61.1 m-85 -143.54 143.36 31.5 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 -178.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.3 mt -80.22 125.2 38.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.759 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.6 m -95.57 140.06 30.94 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.13 -40.25 97.05 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.576 0.35 . . . . 0.0 111.532 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.57 -37.06 80.06 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.05 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 67.5 tt0 -77.3 -36.83 53.79 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.662 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.415 ' O ' HG12 ' A' ' 108' ' ' VAL . 7.9 tt -66.55 -36.8 83.56 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.402 ' HB2' HG23 ' A' ' 121' ' ' VAL . 2.7 tmt_? -62.0 -40.82 96.94 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -64.36 -44.95 89.83 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.328 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.556 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.2 p -66.51 -32.3 57.45 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.172 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 20.5 mmt -64.39 -40.12 95.2 Favored 'General case' 0 CA--C 1.5 -0.965 0 N-CA-C 111.89 0.329 . . . . 0.0 111.89 178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.4 m -62.52 -35.85 80.72 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -74.45 -28.94 61.26 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.913 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 70.4 mt -90.64 -14.87 31.49 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 121.139 0.495 . . . . 0.0 110.25 -176.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.58 3.47 86.33 Favored Glycine 0 N--CA 1.436 -1.346 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.889 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.522 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 24.0 mm-40 -70.67 -30.46 67.06 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.981 0.39 . . . . 0.0 110.01 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 51.93 86.6 0.04 OUTLIER 'General case' 0 C--O 1.246 0.91 0 O-C-N 124.594 1.184 . . . . 0.0 112.569 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 62.4 mt -113.05 148.8 34.43 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.217 -178.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 9.4 p -77.09 165.21 24.9 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.993 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.9 -40.29 97.11 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.46 -35.64 81.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.891 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.77 -55.65 16.14 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.701 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.402 HG23 ' HB2' ' A' ' 106' ' ' ARG . 15.1 m -64.16 -33.13 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.421 -178.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -63.85 -43.13 97.07 Favored 'General case' 0 CA--C 1.507 -0.68 0 C-N-CA 123.193 0.597 . . . . 0.0 109.642 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -67.36 -43.66 80.9 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.907 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.502 ' HA ' ' CZ ' ' B' ' 81' ' ' PHE . 62.8 mtt -57.8 -48.9 78.39 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.941 177.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.4 mm -64.26 -43.38 97.23 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.579 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.556 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -56.24 -44.32 79.52 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 123.09 0.556 . . . . 0.0 112.182 -176.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -71.56 -31.74 67.32 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 119.924 -0.711 . . . . 0.0 110.88 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.412 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -79.5 -30.51 42.0 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.645 -178.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -72.47 91.91 1.42 Allowed 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 124.454 1.102 . . . . 0.0 108.07 173.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 68.2 mt -81.72 -42.41 19.27 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.786 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.274 -173.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -79.54 -12.05 59.87 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.892 -176.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.35 50.45 5.07 Favored Glycine 0 C--N 1.31 -0.911 0 C-N-CA 120.431 -0.89 . . . . 0.0 113.609 175.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -100.27 -15.54 18.02 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 122.074 0.94 . . . . 0.0 108.51 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 94.5 -0.1 65.33 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.486 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 24.0 mt-30 -142.29 140.92 32.35 Favored 'General case' 0 N--CA 1.429 -1.52 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 -178.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -99.1 122.17 50.54 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -175.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.464 ' ND2' ' HG3' ' A' ' 140' ' ' GLU . 0.5 OUTLIER -85.56 171.75 11.48 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.941 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.591 ' O ' HG11 ' A' ' 142' ' ' VAL . 75.2 t80 -54.57 -47.0 73.81 Favored 'General case' 0 C--O 1.219 -0.502 0 C-N-CA 123.225 0.61 . . . . 0.0 112.325 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.76 -23.67 67.46 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.072 0.463 . . . . 0.0 112.095 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.464 ' HG3' ' ND2' ' A' ' 137' ' ' ASN . 44.5 mt-10 -86.89 -37.86 17.28 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-O 121.713 0.768 . . . . 0.0 108.977 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -70.34 -30.47 67.43 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.3 -0.864 . . . . 0.0 112.102 -179.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.591 HG11 ' O ' ' A' ' 138' ' ' TYR . 28.9 m -59.83 -35.01 57.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -76.96 -34.11 57.62 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.644 0.735 . . . . 0.0 109.41 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.412 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 92.6 mmm -76.24 -35.65 58.88 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.403 -176.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.408 ' O ' ' HE2' ' A' ' 148' ' ' LYS . 14.6 tpt -65.13 -38.64 91.29 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.354 -178.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 8.2 m -82.46 -9.45 59.43 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-O 121.544 0.688 . . . . 0.0 110.71 -179.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -88.33 78.08 8.05 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.372 0.606 . . . . 0.0 110.6 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.439 ' HD3' ' HA ' ' B' ' 86' ' ' LYS . 57.1 mttm . . . . . 0 C--N 1.307 -1.278 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 N--CA 1.434 -1.239 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -76.67 -176.11 2.97 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 123.176 2.584 . . . . 0.0 113.234 -177.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -145.41 88.99 1.89 Allowed 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -132.29 -35.79 1.16 Allowed 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -176.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 7.2 m -55.25 -63.34 1.19 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.108 0.563 . . . . 0.0 111.034 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -113.37 -22.64 10.3 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 177.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 72.3 t60 71.16 -59.69 0.54 Allowed 'General case' 0 C--O 1.216 -0.659 0 C-N-CA 125.88 1.672 . . . . 0.0 111.926 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . 0.502 ' CZ ' ' HA ' ' A' ' 124' ' ' MET . 16.2 t80 -60.01 -54.37 46.83 Favored 'General case' 0 C--O 1.203 -1.366 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -178.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -57.19 -47.11 82.08 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 124.0 0.813 . . . . 0.0 111.383 -176.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . 0.406 ' O ' ' HB3' ' B' ' 86' ' ' LYS . 1.6 mp0 -66.43 -41.91 88.49 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 178.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -69.8 -41.78 74.58 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.99 0.424 . . . . 0.0 110.47 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 77.3 t-105 -66.31 -22.72 66.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 122.673 1.225 . . . . 0.0 109.196 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . 0.545 ' O ' ' HG3' ' B' ' 90' ' ' GLN . 85.2 tttt -78.97 -63.59 1.38 Allowed 'General case' 0 C--N 1.267 -3.016 0 CA-C-N 115.049 -0.978 . . . . 0.0 108.808 174.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 31.1 m170 -63.71 -52.14 61.87 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -170.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.12 -29.94 69.82 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.164 0.507 . . . . 0.0 111.126 -176.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 42.8 mm -83.14 -28.62 7.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.22 -178.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . 0.545 ' HG3' ' O ' ' B' ' 86' ' ' LYS . 50.7 mt-30 -62.65 -46.48 88.02 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 174.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . 0.522 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 24.6 tptm -64.68 -25.91 68.15 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.082 -1.417 . . . . 0.0 112.164 -178.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . 0.44 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -76.83 -10.85 59.66 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -176.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -60.93 -28.82 69.22 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -172.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -145.59 165.36 28.88 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.473 ' HB2' ' HD3' ' B' ' 96' ' ' PRO . 1.7 mpt? -64.7 -57.65 15.9 Favored Pre-proline 0 C--O 1.219 -0.527 0 C-N-CA 120.244 -0.582 . . . . 0.0 110.02 173.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.473 ' HD3' ' HB2' ' B' ' 95' ' ' MET . 18.9 Cg_endo -97.01 60.97 0.11 Allowed 'Trans proline' 0 C--N 1.37 1.702 0 C-N-CA 122.081 1.854 . . . . 0.0 108.491 174.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . 0.403 ' CG ' ' HZ1' ' A' ' 75' ' ' LYS . 21.2 t70 -83.47 125.71 73.27 Favored Pre-proline 0 C--N 1.315 -0.93 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.902 -173.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -91.6 117.9 0.49 Allowed 'Trans proline' 0 N--CA 1.417 -3.026 0 C-N-CA 122.027 1.818 . . . . 0.0 110.578 172.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 37.8 p-90 -90.01 12.77 16.61 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-O 122.032 0.92 . . . . 0.0 109.077 174.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . 0.678 ' HA ' ' CZ ' ' A' ' 68' ' ' PHE . . . . . . . . 0 N--CA 1.401 -2.925 0 N-CA-C 104.872 -2.27 . . . . 0.0 104.872 176.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.285 0 CA-C-O 120.957 0.408 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -94.02 81.47 4.13 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.464 0.65 . . . . 0.0 110.28 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -128.06 97.52 4.81 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.782 178.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.412 ' HB3' HD13 ' A' ' 9' ' ' ILE . 8.9 tp -129.96 130.26 44.83 Favored 'General case' 0 N--CA 1.42 -1.963 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.23 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.6 p -73.17 151.47 41.5 Favored 'General case' 0 N--CA 1.424 -1.727 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.271 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -53.92 -43.12 69.47 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -173.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -70.0 -33.38 71.96 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.853 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -61.64 -48.89 78.83 Favored 'General case' 0 C--O 1.212 -0.884 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 175.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 43.3 mt -60.51 -33.66 55.25 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.683 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.601 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 13' ' ' LYS . . . -65.29 -41.05 94.53 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.534 0.683 . . . . 0.0 110.25 175.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -65.88 -37.78 87.04 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.355 0.598 . . . . 0.0 109.634 175.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.54 ' HZ ' ' SD ' ' A' ' 76' ' ' MET . 46.4 m-85 -69.67 -25.05 63.71 Favored 'General case' 0 C--O 1.176 -2.791 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.885 177.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 33.1 mmtp -60.28 -47.78 84.56 Favored 'General case' 0 C--O 1.25 1.125 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 172.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.55 -55.39 20.8 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.379 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.89 82.32 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.166 -0.925 . . . . 0.0 113.136 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -65.6 -45.79 81.82 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -69.14 -16.92 63.76 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.681 -177.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.48 -42.27 99.36 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 171.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -81.32 -51.36 8.45 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.825 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -70.64 98.89 1.57 Allowed 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.801 0.81 . . . . 0.0 110.551 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mmtm -77.56 -15.82 59.01 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 114.793 -1.094 . . . . 0.0 113.366 -174.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.478 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 11.1 m-20 -95.42 -14.38 23.84 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.648 -176.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.26 40.34 87.59 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.478 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 5.5 p30 -113.12 -15.23 12.82 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -175.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.23 14.08 60.91 Favored Glycine 0 C--N 1.313 -0.696 0 C-N-CA 120.961 -0.637 . . . . 0.0 113.539 178.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.5 p -134.76 131.39 37.5 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 174.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.8 mt -104.72 121.34 56.45 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.3 p -92.74 171.99 8.64 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.689 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.7 p -59.81 -35.34 74.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.558 0.694 . . . . 0.0 109.648 176.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -54.43 -51.0 66.33 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.109 1.364 . . . . 0.0 110.506 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -70.84 -36.38 72.86 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.272 -175.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 85.5 mt -61.65 -51.22 69.36 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 175.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.1 -29.45 74.45 Favored Glycine 0 N--CA 1.441 -1.021 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.428 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -61.18 -53.28 58.88 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 116.975 0.388 . . . . 0.0 110.433 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.9 m -71.02 -31.54 45.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.349 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.442 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 64.9 mtt -68.14 -37.74 81.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.221 177.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -65.11 -31.9 73.34 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 177.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.6 m -75.33 -13.86 60.44 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.545 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -104.57 6.14 34.35 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.167 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.02 23.14 64.32 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 116.0 -0.545 . . . . 0.0 113.524 178.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.459 ' HG3' ' HD3' ' A' ' 43' ' ' PRO . 5.4 tp-100 -120.8 131.53 54.51 Favored 'General case' 0 N--CA 1.424 -1.754 0 O-C-N 122.226 -0.573 . . . . 0.0 110.474 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.428 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -123.29 79.32 53.11 Favored Pre-proline 0 C--N 1.296 -1.737 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.441 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.459 ' HD3' ' HG3' ' A' ' 41' ' ' GLN . 31.8 Cg_exo -65.89 164.24 27.89 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 122.188 1.925 . . . . 0.0 110.84 176.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.417 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 46.9 p -76.75 166.02 23.94 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 -179.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -60.07 -36.47 77.42 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.89 -45.78 93.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.66 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.417 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 34.1 mm-40 -60.49 -43.45 96.98 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.443 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.05 -46.8 76.49 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.95 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 47.1 tp60 -68.64 -42.65 77.68 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -61.39 -42.24 98.4 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.375 0.607 . . . . 0.0 109.854 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 45.0 ttm -54.31 -46.85 72.91 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.506 177.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 40.2 mt -67.54 -53.61 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.178 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -54.99 -27.54 44.98 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -172.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -66.65 -42.3 86.87 Favored 'General case' 0 N--CA 1.386 -3.658 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 178.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.44 HG13 ' SD ' ' A' ' 71' ' ' MET . 4.3 m -94.82 -14.59 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-O 120.863 0.363 . . . . 0.0 111.321 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -69.28 104.83 2.33 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.54 -35.61 22.74 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.364 -173.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -91.01 -10.55 41.86 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.593 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.65 52.21 36.06 Favored Glycine 0 C--O 1.239 0.429 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.768 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -107.69 -13.89 14.93 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.537 0.208 . . . . 0.0 111.452 -178.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.9 -3.27 33.79 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.239 -0.982 . . . . 0.0 113.563 179.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.9 p -127.83 151.25 49.28 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 117.504 0.652 . . . . 0.0 110.84 178.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.1 mt -91.58 104.69 15.78 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.086 0 N-CA-C 104.198 -2.519 . . . . 0.0 104.198 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.13 158.82 20.29 Favored 'General case' 0 C--N 1.283 -2.303 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -175.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.429 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 52.0 t80 -51.46 -51.69 66.85 Favored Pre-proline 0 CA--C 1.554 1.122 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -176.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.429 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 8.5 Cg_endo -50.52 -44.57 39.18 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.774 2.316 . . . . 0.0 112.838 175.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -69.04 -36.94 78.27 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.537 0.684 . . . . 0.0 110.304 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -63.54 -39.64 94.94 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.092 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 87.2 mt -65.86 -44.02 86.67 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.141 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 93.2 m -54.99 -49.12 72.27 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 123.867 0.73 . . . . 0.0 109.656 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.44 ' SD ' HG13 ' A' ' 55' ' ' VAL . 17.9 ttp -54.41 -52.76 60.71 Favored 'General case' 0 C--O 1.199 -1.591 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.861 176.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.438 ' HE3' ' HE3' ' A' ' 71' ' ' MET . 23.0 mmt -64.23 -42.67 96.46 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -174.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.39 -35.25 71.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.625 0.726 . . . . 0.0 110.486 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.509 ' HB3' ' OG1' ' A' ' 79' ' ' THR . 66.4 mtp180 -83.8 -32.79 25.16 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.126 178.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -83.29 -35.57 25.17 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 123.077 0.551 . . . . 0.0 112.22 -168.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.54 ' SD ' ' HZ ' ' A' ' 12' ' ' PHE . 63.6 mtm -80.4 -40.78 25.82 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.489 0.662 . . . . 0.0 110.542 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -81.09 -23.41 38.45 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.806 -1.088 . . . . 0.0 113.008 -173.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.4 t70 84.66 124.57 0.04 OUTLIER 'General case' 0 CA--C 1.487 -1.476 0 C-N-CA 125.544 1.538 . . . . 0.0 107.789 -167.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.509 ' OG1' ' HB3' ' A' ' 74' ' ' ARG . 22.2 m -76.13 -67.98 0.63 Allowed 'General case' 0 N--CA 1.409 -2.52 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.525 -172.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.487 ' OD1' ' HB3' ' A' ' 82' ' ' GLU . 21.1 t70 -141.24 -19.18 0.79 Allowed 'General case' 0 C--N 1.275 -2.662 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.894 -172.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.557 ' O ' HG12 ' A' ' 85' ' ' ILE . 50.4 m 75.5 -55.78 0.62 Allowed 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 125.17 1.388 . . . . 0.0 110.62 -176.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.487 ' HB3' ' OD1' ' A' ' 80' ' ' ASP . 20.0 tp10 -58.71 -48.73 80.14 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.271 0.628 . . . . 0.0 109.751 179.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -64.73 -27.45 68.92 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 121.056 0.455 . . . . 0.0 111.542 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.66 -27.25 55.54 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.858 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.557 HG12 ' O ' ' A' ' 81' ' ' SER . 27.2 mm -72.32 -38.61 61.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 174.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 86' ' ' ARG . 49.2 ttp180 -61.74 -42.77 99.4 Favored 'General case' 0 C--O 1.21 -0.996 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.296 174.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -56.33 -51.75 67.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.04 -43.64 91.68 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.197 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.36 -54.02 49.18 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.68 -43.67 69.09 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 125.166 1.386 . . . . 0.0 112.707 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 11.9 p -72.15 -25.94 24.28 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.536 -176.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -82.06 -56.07 4.18 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 175.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -84.23 85.07 7.41 Favored 'General case' 0 C--O 1.252 1.212 0 CA-C-O 122.124 0.964 . . . . 0.0 110.663 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -78.65 -35.02 45.97 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 114.447 -1.251 . . . . 0.0 112.798 -178.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -73.32 -13.57 61.14 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 121.186 0.517 . . . . 0.0 111.003 -178.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.63 52.6 9.62 Favored Glycine 0 N--CA 1.43 -1.715 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -87.94 -18.62 28.72 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.22 6.07 88.34 Favored Glycine 0 CA--C 1.501 -0.805 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.47 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 98.5 m-85 -147.34 149.85 33.6 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 -178.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.411 ' HB ' HG12 ' A' ' 136' ' ' VAL . 3.9 mt -93.48 123.3 45.52 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.875 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 175.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 29.9 t -104.06 151.94 22.65 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 123.723 0.809 . . . . 0.0 109.451 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.31 -34.91 79.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.776 178.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.25 86.23 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.089 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.555 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 2.1 tp10 -68.33 -41.17 81.19 Favored 'General case' 0 CA--C 1.503 -0.856 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.437 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -61.43 -39.32 90.37 Favored 'General case' 0 N--CA 1.427 -1.601 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -175.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.581 ' HG3' HG23 ' A' ' 121' ' ' VAL . 19.5 mtm180 -56.65 -42.8 79.57 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.401 172.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.555 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 50.3 m170 -54.52 -56.04 22.97 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.584 0.753 . . . . 0.0 110.697 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 6.2 p -70.94 -35.65 60.5 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.137 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.187 -174.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 22.7 mmt -63.49 -45.28 91.44 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -177.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.8 p -65.23 -36.01 82.82 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-O 121.135 0.493 . . . . 0.0 110.129 176.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -66.0 -32.58 74.14 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.696 178.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 78.9 mt -85.05 -17.91 36.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.824 -177.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 80.33 23.84 60.16 Favored Glycine 0 N--CA 1.435 -1.414 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.451 -177.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -84.99 -35.22 22.11 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 55.4 tptt 47.58 88.25 0.02 OUTLIER 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.648 1.579 . . . . 0.0 113.611 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 64.6 mt -101.06 155.63 17.88 Favored 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 24.3 p -75.78 166.09 24.06 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 175.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -63.52 -34.14 77.14 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -64.13 -44.58 91.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.159 176.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.443 ' HG3' ' CE2' ' B' ' 81' ' ' PHE . 14.2 tt0 -70.5 -35.66 73.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.855 -174.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.581 HG23 ' HG3' ' A' ' 106' ' ' ARG . 19.2 m -72.52 -33.27 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.897 176.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -70.94 -41.86 70.57 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.284 -177.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.511 ' HB2' ' CZ ' ' B' ' 81' ' ' PHE . 48.9 mm-40 -68.55 -31.08 70.04 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.016 177.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.4 mtt -58.8 -48.53 80.96 Favored 'General case' 0 CA--C 1.497 -1.071 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.263 175.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.11 -46.57 96.18 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.533 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.656 178.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -55.67 -44.41 77.26 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.25 0.62 . . . . 0.0 111.48 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -66.17 -28.82 69.07 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.094 0.558 . . . . 0.0 111.37 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -97.52 -20.57 17.64 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.624 -0.431 . . . . 0.0 112.05 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.411 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 5.4 t70 -70.24 93.22 0.82 Allowed 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 124.052 0.941 . . . . 0.0 110.244 177.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.1 mt -84.53 -40.31 15.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.229 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -83.76 -10.99 57.72 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.259 0.552 . . . . 0.0 112.305 -172.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.411 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 75.64 55.75 4.87 Favored Glycine 0 C--N 1.307 -1.083 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.587 176.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -111.84 -17.08 13.02 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 177.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.32 4.62 60.94 Favored Glycine 0 N--CA 1.439 -1.136 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.47 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 26.7 mt-30 -147.76 145.12 28.69 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.411 HG12 ' HB ' ' A' ' 100' ' ' ILE . 1.0 OUTLIER -102.81 120.4 52.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -176.094 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -86.05 168.3 14.22 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.427 ' O ' HG12 ' A' ' 142' ' ' VAL . 68.2 t80 -55.62 -46.83 77.33 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.971 0.909 . . . . 0.0 112.852 -174.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -67.45 -26.61 66.48 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -178.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -73.62 -44.87 55.88 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -63.95 -38.7 92.04 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.759 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 138' ' ' TYR . 15.9 m -66.85 -35.02 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.633 177.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -72.73 -37.98 67.56 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -72.54 -50.88 22.6 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.917 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -35.67 79.44 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.167 0.587 . . . . 0.0 110.548 -174.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 17.0 m -80.55 -6.33 58.08 Favored 'General case' 0 CA--C 1.561 1.376 0 CA-C-O 121.583 0.706 . . . . 0.0 110.745 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -120.27 19.35 12.16 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 122.364 1.078 . . . . 0.0 109.919 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 12.0 ttpp . . . . . 0 C--N 1.278 -2.51 0 CA-C-N 113.858 -1.519 . . . . 0.0 108.281 -178.556 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.448 -0.527 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -80.75 -25.68 4.19 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 122.765 2.31 . . . . 0.0 112.683 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.29 -6.77 52.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.759 0.314 . . . . 0.0 110.424 -178.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 67.99 82.13 0.18 Allowed 'General case' 0 C--O 1.25 1.094 0 C-N-CA 124.741 1.216 . . . . 0.0 110.19 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 16.3 m -67.08 -22.4 65.84 Favored 'General case' 0 C--N 1.307 -1.239 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.347 -177.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -69.7 -51.05 37.91 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -63.34 -47.23 83.04 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.349 -0.842 . . . . 0.0 109.265 177.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . 0.511 ' CZ ' ' HB2' ' A' ' 123' ' ' GLU 0.322 64.4 m-85 -74.41 -16.27 60.89 Favored 'General case' 0 N--CA 1.422 -1.86 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 -175.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -71.66 -28.93 64.07 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 176.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -77.16 -45.08 27.94 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 175.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.73 -49.98 74.76 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.512 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -60.22 -38.14 82.47 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -63.38 -29.97 71.18 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 121.364 0.602 . . . . 0.0 110.897 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -84.12 -43.56 14.91 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.091 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.0 -56.76 18.05 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 123.732 0.813 . . . . 0.0 112.312 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 74.2 mt -62.15 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.086 0.469 . . . . 0.0 110.672 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -66.64 -36.31 82.28 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.286 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -73.16 -38.58 66.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.37 -41.2 94.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.978 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -72.23 -7.13 47.63 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.079 0.466 . . . . 0.0 110.034 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 31.3 m170 83.04 123.65 0.04 OUTLIER 'General case' 0 CA--C 1.504 -0.817 0 C-N-CA 127.001 2.12 . . . . 0.0 113.386 177.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.442 ' HB2' ' HD3' ' B' ' 96' ' ' PRO . 84.8 mtp -90.9 -51.1 0.32 Allowed Pre-proline 0 C--N 1.314 -0.966 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.628 171.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.442 ' HD3' ' HB2' ' B' ' 95' ' ' MET . 16.2 Cg_exo -70.89 98.59 0.8 Allowed 'Trans proline' 0 C--N 1.389 2.703 0 N-CA-C 106.627 -2.105 . . . . 0.0 106.627 164.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -170.22 159.44 6.36 Favored Pre-proline 0 C--N 1.296 -1.726 0 N-CA-C 105.489 -2.041 . . . . 0.0 105.489 -167.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -62.35 85.22 0.1 Allowed 'Trans proline' 0 N--CA 1.45 -1.082 0 C-N-CA 122.035 1.824 . . . . 0.0 111.596 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 6.0 t-105 -114.83 99.18 7.29 Favored 'General case' 0 N--CA 1.413 -2.298 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.289 -2.064 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.093 -177.535 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.712 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.472 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 8.9 p-10 -154.38 12.28 0.41 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.093 0.473 . . . . 0.0 111.114 -178.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -119.03 138.37 52.89 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.252 0.549 . . . . 0.0 110.097 -175.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.491 ' HB3' ' HB2' ' A' ' 8' ' ' GLN . 2.9 mm? -131.31 175.29 9.25 Favored 'General case' 0 N--CA 1.416 -2.156 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.432 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 25.0 p -79.96 160.89 25.78 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -62.19 -31.4 71.91 Favored 'General case' 0 C--O 1.203 -1.375 0 C-N-CA 121.218 -0.193 . . . . 0.0 110.754 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -63.41 -42.34 98.76 Favored 'General case' 0 C--N 1.314 -0.974 0 O-C-N 123.5 0.5 . . . . 0.0 111.057 177.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.491 ' HB2' ' HB3' ' A' ' 4' ' ' LEU . 27.6 mm-40 -64.67 -47.9 76.73 Favored 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.8 mt -56.8 -39.33 63.58 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.31 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.4 89.58 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 123.521 0.728 . . . . 0.0 111.069 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -61.85 -44.34 97.03 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.554 0.692 . . . . 0.0 109.444 176.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -68.28 -29.76 68.62 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.444 -178.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -68.42 -33.54 74.39 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.982 175.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -68.49 -50.03 55.36 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.7 -43.09 72.2 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.771 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.411 ' HZ ' ' C ' ' A' ' 25' ' ' GLY . 70.2 t80 -59.17 -44.0 92.14 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.777 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.5 m -74.52 -20.87 59.81 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.733 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.256 2.9 tm? -68.67 -50.65 49.38 Favored 'General case' 0 CA--C 1.483 -1.63 0 N-CA-C 106.198 -1.779 . . . . 0.0 106.198 175.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.43 ' CZ ' HD23 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -77.39 -41.1 41.35 Favored 'General case' 0 N--CA 1.383 -3.809 0 CA-C-N 111.616 -2.538 . . . . 0.0 111.62 -167.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -69.97 96.28 1.02 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -74.13 -36.95 64.22 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.192 -0.913 . . . . 0.0 113.291 -174.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -93.08 -13.57 28.4 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.231 -177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.07 57.4 8.64 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 121.313 -0.47 . . . . 0.0 113.593 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -113.74 -11.96 12.84 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 116.913 0.356 . . . . 0.0 111.053 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.411 ' C ' ' HZ ' ' A' ' 16' ' ' PHE . . . 102.66 5.75 47.73 Favored Glycine 0 N--CA 1.43 -1.704 0 C-N-CA 119.833 -1.175 . . . . 0.0 113.118 -178.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.0 p -145.57 156.39 43.66 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 117.721 0.761 . . . . 0.0 111.011 173.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 72.5 mt -107.56 109.12 27.04 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.6 p -84.96 167.93 15.44 Favored 'General case' 0 C--N 1.288 -2.072 0 O-C-N 122.202 -0.312 . . . . 0.0 110.962 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -56.56 -34.36 67.03 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 123.304 0.642 . . . . 0.0 111.226 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.405 ' HZ2' ' CD ' ' A' ' 45' ' ' GLU . 49.2 mmtm -59.65 -42.15 92.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.819 178.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -70.25 -33.31 71.46 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.933 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.43 HD23 ' CZ ' ' A' ' 19' ' ' PHE . 65.2 mt -56.25 -59.73 4.52 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 174.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.14 -26.8 64.1 Favored Glycine 0 C--O 1.19 -2.652 0 CA-C-N 114.599 -1.182 . . . . 0.0 112.968 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.4 m -65.24 -53.55 42.66 Favored 'General case' 0 CA--C 1.558 1.286 0 CA-C-N 117.734 0.767 . . . . 0.0 110.705 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.1 m -72.27 -32.56 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.32 0.581 . . . . 0.0 109.861 -178.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.41 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 66.9 mtp -72.33 -29.24 63.64 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.589 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -68.15 -36.12 79.15 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 175.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -63.43 -27.46 69.3 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.02 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.426 HD13 ' HD2' ' B' ' 91' ' ' LYS . 4.6 mm? -85.51 -13.54 48.71 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.105 0.478 . . . . 0.0 111.052 177.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.14 16.81 36.74 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.153 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -106.16 130.56 54.02 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -124.38 83.99 56.84 Favored Pre-proline 0 C--N 1.3 -1.545 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.965 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.454 ' HG2' HD21 ' A' ' 48' ' ' LEU . 6.2 Cg_endo -85.73 164.55 10.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.46 2.107 . . . . 0.0 111.117 173.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.0 p -86.9 169.13 12.78 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 120.932 0.396 . . . . 0.0 111.349 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.405 ' CD ' ' HZ2' ' A' ' 30' ' ' LYS . 16.7 tp10 -58.71 -45.58 89.24 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 125.275 1.43 . . . . 0.0 110.229 -176.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.88 95.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.512 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 51' ' ' MET . 40.0 mt-10 -61.67 -47.22 86.34 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.006 0.432 . . . . 0.0 110.128 178.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.454 HD21 ' HG2' ' A' ' 43' ' ' PRO . 95.8 mt -64.82 -38.39 90.82 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.755 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -61.1 -46.05 92.21 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.993 176.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -62.8 -39.93 95.79 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 123.37 0.419 . . . . 0.0 111.241 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.439 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 67.9 mtt -60.78 -45.76 93.11 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.024 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 23.4 mt -73.48 -36.81 49.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.77 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -57.9 -22.46 48.58 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 123.086 0.554 . . . . 0.0 112.346 -176.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -64.09 -32.82 74.52 Favored 'General case' 0 N--CA 1.386 -3.651 0 C-N-CA 124.261 1.024 . . . . 0.0 111.398 176.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.469 ' CG1' ' HB2' ' A' ' 71' ' ' MET . 10.9 m -107.53 -22.81 4.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-O 121.259 0.552 . . . . 0.0 110.086 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -73.08 116.02 13.11 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.48 -174.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.4 -16.07 38.38 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.673 177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -88.88 -11.08 45.65 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.081 -175.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 56.32 29.79 57.29 Favored Glycine 0 CA--C 1.525 0.664 0 CA-C-N 115.479 -0.782 . . . . 0.0 113.354 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 37.2 p30 -116.33 -12.8 11.07 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 108.78 24.69 5.98 Favored Glycine 0 N--CA 1.44 -1.068 0 C-N-CA 119.489 -1.339 . . . . 0.0 113.582 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.3 p -120.24 131.6 55.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 117.581 0.691 . . . . 0.0 111.814 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.9 mt -94.67 110.21 23.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 170.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -90.98 158.01 16.96 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 178.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.455 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 21.9 t80 -55.8 -47.84 97.86 Favored Pre-proline 0 CA--C 1.555 1.172 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -176.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.5 Cg_endo -50.28 -44.6 37.92 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.607 2.205 . . . . 0.0 112.173 172.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -67.08 -42.3 84.88 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.752 0.421 . . . . 0.0 110.219 -179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' B' ' 100' ' ' ALA . 0.5 OUTLIER -56.51 -50.41 71.88 Favored 'General case' 0 C--O 1.244 0.79 0 C-N-CA 124.358 1.063 . . . . 0.0 109.55 176.352 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.4 mt -61.04 -40.75 94.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.764 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 2' ' ' ASP . 45.0 m -59.26 -48.01 83.22 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.566 177.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.469 ' HB2' ' CG1' ' A' ' 55' ' ' VAL . 29.9 ttp -57.89 -49.99 74.84 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.938 178.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 24.4 mmt -67.39 -43.42 81.39 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 120.252 -0.579 . . . . 0.0 112.43 -176.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 77' ' ' LYS . . . -60.48 -31.36 70.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.041 0.448 . . . . 0.0 111.216 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -80.75 -40.89 24.41 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-O 121.023 0.439 . . . . 0.0 110.871 176.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -77.99 -38.07 45.8 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.146 0.498 . . . . 0.0 110.444 -169.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 46.7 mtm -83.17 -26.94 30.43 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.048 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 73' ' ' ALA . 67.1 mttm -124.84 -82.41 0.64 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -174.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -100.34 84.06 2.74 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -170.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 93.4 m 165.41 57.87 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 129.885 3.274 . . . . 0.0 105.516 172.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 62.45 92.01 0.06 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.961 -177.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.2 t -71.45 -20.18 62.13 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.932 -172.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -90.72 1.98 56.38 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -64.35 -42.48 96.22 Favored 'General case' 0 CA--C 1.507 -0.691 0 C-N-CA 120.074 -0.65 . . . . 0.0 110.126 172.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -58.07 -40.11 80.22 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.887 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 44.9 mm -67.4 -44.51 86.93 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.172 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -71.7 -39.78 69.96 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.491 -178.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -64.82 -40.66 95.56 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 120.827 0.346 . . . . 0.0 110.876 177.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.418 ' HB3' HD12 ' B' ' 89' ' ' ILE . . . -68.02 -35.94 79.13 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.241 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -65.62 -48.58 71.75 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -55.42 -32.63 62.84 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 179.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.403 HG11 ' O ' ' A' ' 88' ' ' ALA . 13.8 p -74.62 -28.84 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.334 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.505 ' O ' ' HG2' ' A' ' 104' ' ' GLU . 88.3 m-85 -89.19 -35.56 16.15 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.417 0.627 . . . . 0.0 110.23 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -88.82 69.31 8.63 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 174.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -66.6 -34.51 78.04 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 113.821 -1.536 . . . . 0.0 112.771 -171.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -90.22 -7.18 54.18 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.422 0.629 . . . . 0.0 110.476 -176.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.06 55.91 6.78 Favored Glycine 0 CA--C 1.502 -0.764 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -104.19 -18.59 14.44 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.973 0.416 . . . . 0.0 110.181 -175.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.9 10.56 66.58 Favored Glycine 0 N--CA 1.436 -1.36 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.036 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -156.32 141.49 17.38 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 120.851 0.357 . . . . 0.0 110.739 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.4 ' HB ' HG11 ' A' ' 136' ' ' VAL . 2.1 mt -97.49 137.02 26.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.241 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 61.9 p -114.99 158.16 22.44 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.496 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.45 -34.84 78.84 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 121.075 0.464 . . . . 0.0 109.879 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.89 -52.01 67.27 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.859 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.686 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 41.1 tp10 -65.61 -43.3 90.03 Favored 'General case' 0 CA--C 1.482 -1.636 0 C-N-CA 120.424 -0.51 . . . . 0.0 111.554 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.1 tt -57.38 -39.28 75.72 Favored 'General case' 0 N--CA 1.423 -1.814 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 -173.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.464 ' HG3' HG23 ' A' ' 121' ' ' VAL . 52.8 mtp180 -65.77 -34.66 78.69 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 173.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.686 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 30.7 m170 -58.98 -55.57 33.46 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.659 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -64.81 -37.74 80.95 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.392 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.732 -176.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.482 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.2 mmt -60.3 -37.94 82.12 Favored 'General case' 0 C--O 1.251 1.149 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 65.1 m -62.25 -40.58 96.67 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.18 177.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.95 -17.06 53.94 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.251 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.659 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 97.2 mt -92.18 -14.1 29.59 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 121.2 0.524 . . . . 0.0 111.83 -176.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 82.2 6.1 89.08 Favored Glycine 0 N--CA 1.437 -1.274 0 C-N-CA 120.272 -0.966 . . . . 0.0 111.418 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.405 ' HB2' ' SD ' ' A' ' 109' ' ' MET . 47.2 mm-40 -73.2 -44.08 60.33 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 67.1 mttm 57.58 90.74 0.04 OUTLIER 'General case' 0 C--O 1.242 0.668 0 O-C-N 124.763 1.29 . . . . 0.0 111.026 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 76.4 mt -125.89 131.28 52.38 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 17.5 p -83.05 176.89 8.88 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.638 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -60.22 -27.74 67.44 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -172.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -68.75 -51.3 42.67 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 118.825 0.739 . . . . 0.0 111.011 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -58.19 -49.78 75.83 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.945 -177.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.464 HG23 ' HG3' ' A' ' 106' ' ' ARG . 4.3 m -69.99 -29.03 38.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.845 -176.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -65.08 -46.95 79.02 Favored 'General case' 0 CA--C 1.485 -1.52 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -63.17 -36.73 84.59 Favored 'General case' 0 N--CA 1.443 -0.79 0 O-C-N 124.157 0.911 . . . . 0.0 109.79 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.9 mtt -59.88 -49.83 76.16 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.14 176.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 47.3 mm -69.03 -54.0 22.7 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.47 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.29 -178.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -57.15 -41.2 78.69 Favored 'General case' 0 C--N 1.309 -1.167 0 C-N-CA 124.806 1.242 . . . . 0.0 112.802 -172.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -81.87 -21.82 37.25 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.925 -0.71 . . . . 0.0 111.698 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -80.08 -36.45 35.5 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 176.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -61.83 104.44 0.45 Allowed 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 125.707 1.603 . . . . 0.0 109.221 175.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 72.1 mt -83.28 -45.25 18.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.65 -175.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -82.26 -11.01 58.91 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.879 -0.601 . . . . 0.0 112.29 -170.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.18 53.95 3.73 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.718 177.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -115.68 -17.59 11.06 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 121.566 0.698 . . . . 0.0 110.435 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.86 9.85 62.07 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -144.95 125.97 14.53 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.4 HG11 ' HB ' ' A' ' 100' ' ' ILE . 1.0 OUTLIER -90.56 117.9 34.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 123.455 0.472 . . . . 0.0 111.702 -178.362 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -84.79 175.66 9.01 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.5 178.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.534 ' O ' HG13 ' A' ' 142' ' ' VAL . 84.2 t80 -62.3 -43.26 99.24 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.709 -177.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -63.77 -21.99 66.69 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -87.78 -35.62 17.76 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -72.98 -36.66 67.13 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.72 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 138' ' ' TYR . 33.8 m -59.48 -35.44 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-O 120.995 0.426 . . . . 0.0 111.7 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -70.51 -29.62 66.18 Favored 'General case' 0 C--O 1.205 -1.241 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.977 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 73.2 mtp -57.78 -40.38 79.71 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.794 0.438 . . . . 0.0 112.09 -177.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 51.8 tpp -74.04 -29.46 61.92 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.22 0.533 . . . . 0.0 110.555 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 8.2 m -80.72 -23.48 39.46 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.777 0.798 . . . . 0.0 108.978 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -109.62 33.27 4.45 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.419 -177.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.4 tttm . . . . . 0 C--N 1.288 -2.104 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 -179.32 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 17.6 m . . . . . 0 N--CA 1.442 -0.86 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.05 119.29 5.01 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.626 2.217 . . . . 0.0 112.171 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -78.87 -74.77 0.26 Allowed 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 175.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -146.71 17.29 1.28 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 174.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -75.67 -20.63 58.3 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 112.618 -2.083 . . . . 0.0 109.949 -176.074 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -121.33 125.26 46.57 Favored 'General case' 0 N--CA 1.411 -2.4 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -178.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -108.99 19.85 19.1 Favored 'General case' 0 C--N 1.281 -2.411 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -41.27 -52.16 3.46 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 127.732 2.413 . . . . 0.0 112.897 -177.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -67.75 -38.21 83.16 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.644 -174.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -82.42 -37.22 25.81 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.96 -47.55 85.91 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.728 0.642 . . . . 0.0 109.679 176.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.628 ' O ' HG12 ' B' ' 89' ' ' ILE . 38.8 m95 -63.71 -43.12 97.53 Favored 'General case' 0 C--O 1.199 -1.573 0 CA-C-O 119.415 -0.326 . . . . 0.0 111.486 175.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -53.09 -51.75 60.82 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.87 0.843 . . . . 0.0 109.191 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -58.24 -45.66 87.35 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 113.43 -1.714 . . . . 0.0 109.595 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.25 -49.4 75.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.13 178.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.628 HG12 ' O ' ' B' ' 85' ' ' TRP . 51.8 mm -57.71 -51.44 70.17 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.468 0 C-N-CA 123.347 0.659 . . . . 0.0 109.312 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -61.8 -28.94 69.82 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.239 -177.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . 0.426 ' HD2' HD13 ' A' ' 39' ' ' LEU . 4.5 tppp? -81.71 -53.29 6.34 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 120.983 0.421 . . . . 0.0 110.975 175.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.93 -44.89 68.69 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -174.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -79.84 4.55 16.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.801 0.81 . . . . 0.0 110.222 -175.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . 0.441 ' CG ' ' HA ' ' B' ' 99' ' ' TRP . 25.1 m170 -116.92 19.21 14.47 Favored 'General case' 0 CA--C 1.489 -1.392 0 O-C-N 121.814 -0.553 . . . . 0.0 111.831 178.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.426 ' HB2' ' HD3' ' B' ' 96' ' ' PRO . 67.5 mtm -75.01 -52.4 3.25 Favored Pre-proline 0 N--CA 1.435 -1.209 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.922 172.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.426 ' HD3' ' HB2' ' B' ' 95' ' ' MET . 23.6 Cg_endo -101.66 13.88 0.38 Allowed 'Trans proline' 0 C--N 1.383 2.347 0 C-N-CA 121.844 1.696 . . . . 0.0 112.29 177.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -138.62 128.85 14.97 Favored Pre-proline 0 C--N 1.315 -0.928 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 -175.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -46.97 117.68 2.31 Favored 'Trans proline' 0 C--O 1.244 0.818 0 C-N-CA 123.594 2.863 . . . . 0.0 113.622 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . 0.441 ' HA ' ' CG ' ' B' ' 94' ' ' HIS . 2.0 t90 -64.97 -32.64 74.47 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.161 175.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . 0.429 ' HA ' ' CE1' ' A' ' 68' ' ' PHE . . . . . . . . 0 N--CA 1.389 -3.491 0 N-CA-C 103.776 -2.676 . . . . 0.0 103.776 -178.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.395 0 N-CA-C 110.984 -0.006 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 72.59 -68.91 0.21 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 125.3 1.44 . . . . 0.0 112.371 173.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.457 ' HA ' ' OE1' ' A' ' 3' ' ' GLN . 10.7 mm-40 54.76 74.88 0.33 Allowed 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 126.109 1.764 . . . . 0.0 113.514 -177.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.457 ' HB3' HD12 ' A' ' 9' ' ' ILE . 14.4 tp -110.88 138.91 46.7 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.429 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 10.0 p -68.15 142.87 55.61 Favored 'General case' 0 N--CA 1.424 -1.726 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.632 178.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -59.18 -33.29 70.77 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 123.936 0.894 . . . . 0.0 112.481 -171.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.452 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 34.2 tt0 -66.38 -41.5 89.32 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.23 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.429 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 12.3 mm100 -67.69 -40.66 84.35 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.569 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 63.5 mt -58.12 -41.38 80.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.926 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.49 95.53 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 121.51 0.671 . . . . 0.0 110.921 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 7' ' ' GLU . 30.3 mt-10 -69.89 -30.96 68.52 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.727 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -75.71 -23.77 56.13 Favored 'General case' 0 C--O 1.189 -2.1 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.979 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -63.38 -46.75 85.03 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 120.838 0.351 . . . . 0.0 110.762 176.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -68.34 -40.06 81.71 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.132 -0.627 . . . . 0.0 111.529 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.04 -38.91 89.56 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-O 121.226 0.536 . . . . 0.0 109.803 178.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -60.06 -46.57 89.1 Favored 'General case' 0 C--O 1.2 -1.548 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.982 176.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.1 m -69.36 -17.2 63.66 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.374 -178.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.72 -33.48 64.38 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 176.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.545 ' CD2' HG21 ' A' ' 35' ' ' VAL . 20.4 m-85 -89.86 -38.61 13.62 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.821 178.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -80.79 97.93 7.56 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 176.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -75.1 -6.92 52.08 Favored 'General case' 0 C--N 1.288 -2.076 0 CA-C-N 115.265 -0.879 . . . . 0.0 113.223 -176.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.42 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 18.9 m-20 -102.67 -14.53 16.66 Favored 'General case' 0 C--O 1.244 0.778 0 C-N-CA 119.379 -0.928 . . . . 0.0 109.38 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.78 45.92 94.21 Favored Glycine 0 C--N 1.339 0.722 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -175.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.42 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 2.7 p30 -113.3 -16.24 12.54 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -173.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.23 4.79 50.25 Favored Glycine 0 C--N 1.309 -0.935 0 C-N-CA 121.149 -0.548 . . . . 0.0 113.355 178.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 79.9 p -132.92 139.32 47.29 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 117.458 0.629 . . . . 0.0 109.63 173.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.9 mt -112.04 129.82 66.82 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.8 p -99.28 174.58 6.23 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.908 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.4 p -66.18 -31.25 71.97 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 121.611 0.72 . . . . 0.0 109.866 176.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -61.56 -50.62 71.91 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.439 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.32 -42.91 92.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.817 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.0 mt -56.78 -53.37 58.56 Favored 'General case' 0 C--O 1.22 -0.452 0 O-C-N 123.573 0.546 . . . . 0.0 111.273 177.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.74 -37.43 94.35 Favored Glycine 0 C--O 1.226 -0.364 0 C-N-CA 120.201 -0.999 . . . . 0.0 112.837 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 70.3 m -62.69 -46.19 89.27 Favored 'General case' 0 C--O 1.25 1.114 0 CA-C-N 116.948 0.374 . . . . 0.0 111.339 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.545 HG21 ' CD2' ' A' ' 19' ' ' PHE . 32.9 m -71.17 -34.05 53.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 C-N-CA 120.164 -0.614 . . . . 0.0 110.56 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.637 ' HB3' ' O ' ' A' ' 41' ' ' GLN . 62.1 mtt -66.99 -36.04 81.28 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.418 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -62.34 -41.31 98.47 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.288 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.9 m -67.68 -27.4 66.81 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.998 176.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 97.4 mt -82.47 -10.5 59.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.803 0.335 . . . . 0.0 111.125 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.83 24.65 48.6 Favored Glycine 0 N--CA 1.439 -1.148 0 C-N-CA 121.169 -0.539 . . . . 0.0 112.815 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.637 ' O ' ' HB3' ' A' ' 36' ' ' MET . 48.5 tt0 -155.23 100.26 2.14 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -122.26 92.59 48.89 Favored Pre-proline 0 C--N 1.304 -1.402 0 C-N-CA 119.265 -0.974 . . . . 0.0 113.443 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.552 ' HD2' ' SD ' ' A' ' 36' ' ' MET . 50.2 Cg_exo -56.8 161.62 9.97 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 123.404 2.736 . . . . 0.0 111.695 171.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.47 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 19.1 p -74.6 160.25 31.1 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -176.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -51.9 -44.45 63.8 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 124.175 0.99 . . . . 0.0 112.613 -177.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.69 76.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.062 0.458 . . . . 0.0 110.962 -178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 51' ' ' MET . 39.9 mm-40 -72.78 -42.75 63.61 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.45 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 44' ' ' THR . 79.2 mt -62.63 -39.53 94.14 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.549 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.9 tp60 -67.22 -35.15 78.99 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.732 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.19 -39.17 78.84 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 123.285 0.366 . . . . 0.0 110.128 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.588 ' SD ' ' HA ' ' B' ' 97' ' ' ASP . 61.5 mtt -57.09 -47.31 81.34 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.027 174.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.9 mt -59.45 -50.35 80.24 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.247 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -63.04 -15.69 57.34 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -173.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -71.16 -39.24 72.05 Favored 'General case' 0 N--CA 1.384 -3.732 0 O-C-N 121.759 -0.588 . . . . 0.0 110.275 175.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.0 m -99.57 -20.69 5.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.307 -177.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -68.04 99.3 0.85 Allowed 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.258 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.45 -29.68 22.63 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.799 -173.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -91.03 -9.79 44.56 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.967 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.94 46.77 70.49 Favored Glycine 0 N--CA 1.441 -0.987 0 CA-C-N 115.399 -0.819 . . . . 0.0 113.255 174.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -101.91 -9.43 20.7 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.308 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.84 -6.3 43.89 Favored Glycine 0 N--CA 1.44 -1.053 0 C-N-CA 120.537 -0.839 . . . . 0.0 113.596 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.8 p -130.01 161.71 30.34 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-N 117.489 0.645 . . . . 0.0 110.991 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.531 ' O ' ' HA ' ' A' ' 26' ' ' THR . 29.1 mt -99.05 119.37 46.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.558 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 7.4 t0 -89.27 161.72 16.24 Favored 'General case' 0 C--N 1.292 -1.922 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -53.53 -53.58 55.28 Favored Pre-proline 0 CA--C 1.569 1.702 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -176.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.558 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 8.7 Cg_endo -50.76 -38.45 56.65 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 123.224 2.616 . . . . 0.0 113.603 174.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -69.62 -37.43 76.83 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.796 0.808 . . . . 0.0 109.688 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -67.63 -39.07 84.66 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.327 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 78.2 mt -62.68 -39.72 94.87 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.492 177.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.7 m -56.07 -48.34 76.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.301 0.572 . . . . 0.0 109.634 176.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 28.3 ttp -60.67 -42.47 97.15 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.596 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 20.9 mmt -73.98 -36.18 64.53 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.26 -41.05 97.12 Favored 'General case' 0 C--O 1.21 -1.005 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 175.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -63.06 -30.03 71.28 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.346 175.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -63.78 -41.03 98.03 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 121.151 0.5 . . . . 0.0 109.934 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.5 mtm -102.23 13.42 34.71 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.564 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -131.36 -73.97 0.53 Allowed 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.354 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -91.17 61.11 4.44 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 122.214 1.007 . . . . 0.0 110.594 -176.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 69.6 m -158.86 129.06 5.86 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 104.818 -2.29 . . . . 0.0 104.818 176.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.83 -31.85 73.05 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.297 0.57 . . . . 0.0 109.545 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.548 ' O ' HG12 ' A' ' 85' ' ' ILE . 37.2 m 83.58 -10.3 0.97 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 168.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -57.05 -44.76 83.32 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 2.2 mp0 -46.87 -57.31 5.06 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 125.757 1.623 . . . . 0.0 110.348 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.59 -45.87 70.86 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.421 -175.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.548 HG12 ' O ' ' A' ' 81' ' ' SER . 19.8 mm -73.67 -35.7 44.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 120.704 0.287 . . . . 0.0 111.393 -174.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -74.68 -32.42 62.2 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -62.04 -45.45 93.51 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 176.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.415 ' O ' HG11 ' A' ' 91' ' ' VAL . . . -67.02 -38.66 86.34 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 113.964 -1.471 . . . . 0.0 111.261 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -66.4 -41.67 88.98 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -53.87 -40.46 66.56 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 111.284 177.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.415 HG11 ' O ' ' A' ' 88' ' ' ALA . 11.6 p -75.58 -29.2 20.5 Favored 'Isoleucine or valine' 0 C--O 1.246 0.911 0 CA-C-O 120.917 0.389 . . . . 0.0 111.188 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -77.32 -62.71 1.57 Allowed 'General case' 0 C--O 1.21 -1.008 0 C-N-CA 119.689 -0.805 . . . . 0.0 111.084 178.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -85.84 94.75 9.23 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.764 0.792 . . . . 0.0 111.704 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -80.44 -17.47 51.64 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 114.912 -1.04 . . . . 0.0 113.367 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -92.65 -12.23 32.12 Favored 'General case' 0 CA--C 1.499 -0.994 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -176.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.95 44.54 30.08 Favored Glycine 0 N--CA 1.444 -0.785 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -93.43 -18.48 22.29 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.0 17.32 74.91 Favored Glycine 0 C--O 1.241 0.537 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.458 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 79.3 m-85 -150.0 152.61 35.18 Favored 'General case' 0 N--CA 1.437 -1.1 0 C-N-CA 124.617 1.167 . . . . 0.0 108.437 -177.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.3 mt -109.61 131.67 59.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.303 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 174.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.5 p -110.32 156.33 20.88 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.19 -41.58 97.07 Favored 'General case' 0 C--O 1.212 -0.882 0 C-N-CA 122.685 0.394 . . . . 0.0 111.504 -178.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.62 -49.14 78.9 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 123.16 0.287 . . . . 0.0 111.035 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -56.44 -52.41 64.78 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.899 0.857 . . . . 0.0 109.7 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.498 ' O ' HG11 ' A' ' 108' ' ' VAL . 8.0 tt -63.54 -40.52 97.21 Favored 'General case' 0 N--CA 1.413 -2.306 0 CA-C-N 113.941 -1.482 . . . . 0.0 110.192 -172.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.427 ' HD2' ' C ' ' A' ' 106' ' ' ARG . 4.9 tmm_? -61.11 -43.1 99.4 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -68.98 -37.52 78.8 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.002 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.582 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.1 p -66.32 -29.89 48.09 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.265 0 C-N-CA 119.497 -0.881 . . . . 0.0 109.623 177.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.4 mmt -60.52 -40.11 90.26 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-O 120.646 0.26 . . . . 0.0 110.593 176.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.3 m -60.83 -40.23 92.0 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.936 175.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -75.4 -17.27 60.24 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.808 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 68.4 mt -98.93 -20.61 16.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.994 0.426 . . . . 0.0 110.857 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.41 11.62 47.56 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.642 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -89.18 137.11 32.62 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -177.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -118.21 90.98 3.45 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-O 121.495 0.664 . . . . 0.0 110.258 177.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 75.9 mt -110.95 167.0 10.58 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 28.7 p -100.7 172.54 7.02 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.8 -24.94 67.96 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -67.87 -40.1 83.63 Favored 'General case' 0 N--CA 1.428 -1.547 0 C-N-CA 123.046 0.538 . . . . 0.0 110.784 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -75.49 -42.94 51.6 Favored 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 121.811 -0.556 . . . . 0.0 111.996 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.425 ' O ' HG12 ' A' ' 125' ' ' ILE . 14.1 m -68.39 -29.58 44.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 C-N-CA 120.285 -0.566 . . . . 0.0 109.913 -178.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -70.67 -43.67 68.64 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.324 176.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -64.2 -35.11 79.72 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.411 ' SD ' HD23 ' A' ' 105' ' ' LEU . 62.8 mtt -54.15 -51.26 64.85 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.151 175.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.5 mm -69.11 -59.72 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.226 -177.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -61.82 -33.53 74.3 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 -170.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.486 ' HB3' ' CE1' ' B' ' 81' ' ' PHE . 14.9 tp10 -81.08 -24.39 37.81 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 119.985 -0.686 . . . . 0.0 110.673 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.683 ' HA ' ' SD ' ' A' ' 144' ' ' MET . . . -91.93 -12.85 32.31 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 122.375 1.083 . . . . 0.0 109.768 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -78.82 72.77 5.36 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 122.819 1.295 . . . . 0.0 110.286 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.412 ' HB ' ' OE1' ' A' ' 140' ' ' GLU . 35.7 mt -82.79 -12.26 12.13 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 CA-C-N 114.291 -1.322 . . . . 0.0 107.938 174.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -79.92 -10.42 59.77 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.81 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.64 40.62 99.39 Favored Glycine 0 N--CA 1.442 -0.964 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.744 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -112.34 -16.42 12.95 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.319 0.581 . . . . 0.0 110.142 -177.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 90.99 14.32 57.91 Favored Glycine 0 C--O 1.25 1.147 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 -177.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.458 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 26.0 mt-30 -150.11 139.49 21.4 Favored 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 124.699 1.2 . . . . 0.0 107.791 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 1.2 p -76.23 123.99 33.54 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.139 0.495 . . . . 0.0 110.977 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -91.71 154.08 19.22 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.537 ' O ' HG11 ' A' ' 142' ' ' VAL . 82.8 t80 -57.95 -48.99 78.32 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 124.328 1.051 . . . . 0.0 110.151 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -66.71 -22.14 66.07 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.412 ' OE1' ' HB ' ' A' ' 130' ' ' ILE . 29.0 mm-40 -87.32 -37.52 17.06 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -69.21 -35.03 75.78 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.295 -178.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.537 HG11 ' O ' ' A' ' 138' ' ' TYR . 22.2 m -65.19 -31.31 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 121.173 0.511 . . . . 0.0 110.066 177.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -70.83 -48.55 53.43 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.683 ' SD ' ' HA ' ' A' ' 128' ' ' ALA . 82.7 mtp -66.59 -15.82 63.72 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.328 -178.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 57.3 tpp -78.76 -41.74 29.88 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-O 120.818 0.342 . . . . 0.0 110.199 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 11.9 t -84.18 -27.89 27.74 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.724 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -84.15 109.62 17.87 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.7 tptp . . . . . 0 C--N 1.294 -1.821 0 CA-C-O 118.647 -0.692 . . . . 0.0 109.155 -178.163 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 36.5 m . . . . . 0 N--CA 1.441 -0.902 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -54.7 -36.47 90.16 Favored 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 123.035 2.49 . . . . 0.0 113.413 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.03 135.41 48.9 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 120.727 0.298 . . . . 0.0 110.671 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -148.85 176.08 10.71 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 96.5 p -83.77 -21.13 32.29 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 173.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 36.9 t80 73.37 9.72 5.1 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.455 1.902 . . . . 0.0 110.488 177.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 47.5 m170 -73.25 -18.18 61.25 Favored 'General case' 0 C--O 1.215 -0.719 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 178.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . 0.486 ' CE1' ' HB3' ' A' ' 127' ' ' GLU . 72.6 t80 -42.18 -41.9 2.83 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 126.855 2.062 . . . . 0.0 111.516 174.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . 0.562 ' O ' ' HB2' ' B' ' 86' ' ' LYS . 64.1 tttp -61.6 -52.09 65.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.14 -177.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -76.82 -27.64 55.24 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-O 121.104 0.478 . . . . 0.0 110.595 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.61 -61.35 2.49 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.582 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.533 ' O ' HG12 ' B' ' 89' ' ' ILE . 57.2 m95 -64.62 -31.05 72.1 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . 0.562 ' HB2' ' O ' ' B' ' 82' ' ' LYS . 78.8 tttt -52.98 -50.02 64.99 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 124.454 1.102 . . . . 0.0 109.866 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -76.38 -41.17 48.92 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.461 177.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.13 -59.8 4.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -177.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.533 HG12 ' O ' ' B' ' 85' ' ' TRP . 32.1 pt -68.56 -27.94 38.33 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.707 0 C-N-CA 120.389 -0.524 . . . . 0.0 111.216 -178.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . 0.402 ' HB2' ' O ' ' B' ' 86' ' ' LYS . 8.8 tt0 -62.81 -61.76 2.19 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -65.31 -35.19 80.24 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.285 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.02 -33.24 65.62 Favored 'General case' 0 C--O 1.247 0.926 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.519 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 25.0 tptp -63.8 -53.09 56.31 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 52.5 85.49 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.727 0 O-C-N 124.417 1.073 . . . . 0.0 110.442 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 37.1 ttm -121.07 147.82 47.49 Favored Pre-proline 0 C--N 1.298 -1.673 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.429 -172.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -80.47 -152.76 0.04 OUTLIER 'Trans proline' 0 CA--C 1.547 1.131 0 C-N-CA 122.416 2.077 . . . . 0.0 108.346 167.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . 0.588 ' HA ' ' SD ' ' A' ' 51' ' ' MET . 22.8 m-20 66.78 -178.97 0.04 OUTLIER Pre-proline 0 N--CA 1.488 1.471 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 -179.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . 0.474 ' CD ' ' HB3' ' B' ' 97' ' ' ASP . 2.2 Cg_endo -83.05 76.58 3.95 Favored 'Trans proline' 0 N--CA 1.443 -1.485 0 CA-C-N 121.097 1.428 . . . . 0.0 108.576 173.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 21.1 t90 -85.62 135.8 33.64 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 113.744 -1.571 . . . . 0.0 114.716 -171.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.604 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 169.176 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.371 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.6 t70 68.66 -61.07 0.42 Allowed 'General case' 0 N--CA 1.499 1.976 0 C-N-CA 125.574 1.55 . . . . 0.0 112.829 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.425 ' HA ' ' OE1' ' A' ' 3' ' ' GLN . 15.9 mm-40 -92.18 119.11 31.51 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.122 0.487 . . . . 0.0 109.813 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.419 ' HB3' HD13 ' A' ' 9' ' ' ILE . 10.2 tp -92.67 142.06 27.78 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.826 -174.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 21.2 p -80.81 155.95 26.38 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.816 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -57.45 -44.23 84.61 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -173.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -69.18 -34.05 74.33 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.57 -177.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -63.55 -44.14 95.01 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.488 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 29.6 mt -61.61 -33.25 56.46 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.103 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.541 179.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.13 -46.17 85.3 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-O 121.019 0.437 . . . . 0.0 110.454 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.32 -48.94 75.69 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.406 -0.815 . . . . 0.0 108.986 175.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.413 ' CD2' HD23 ' A' ' 4' ' ' LEU . 56.6 m-85 -71.41 -16.6 62.4 Favored 'General case' 0 C--O 1.187 -2.187 0 CA-C-N 115.324 -0.853 . . . . 0.0 113.148 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 96.0 mttt -69.12 -43.83 73.63 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-O 121.539 0.685 . . . . 0.0 109.279 173.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -71.49 -41.13 69.69 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.644 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.43 -27.96 65.72 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.332 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 26.2 t80 -64.88 -52.74 54.89 Favored 'General case' 0 C--O 1.198 -1.623 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -71.84 -16.76 62.17 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 123.389 0.431 . . . . 0.0 110.836 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.4 tp -65.72 -36.55 83.93 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 174.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.403 ' CE2' HG23 ' A' ' 35' ' ' VAL . 6.5 m-85 -89.4 -41.86 11.86 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.619 175.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -80.65 81.94 6.78 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-O 122.582 1.182 . . . . 0.0 109.588 176.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -75.96 -19.61 58.6 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 114.287 -1.324 . . . . 0.0 112.861 -173.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.589 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 24.7 m-20 -78.15 -14.46 59.46 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.218 178.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.18 33.37 85.01 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.589 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 6.3 p-10 -112.97 -16.24 12.71 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.939 0.399 . . . . 0.0 110.793 -176.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.28 26.33 14.25 Favored Glycine 0 N--CA 1.441 -1.002 0 N-CA-C 115.635 1.014 . . . . 0.0 115.635 176.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.3 p -141.68 130.53 23.0 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 118.233 1.017 . . . . 0.0 109.096 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 61.2 mt -91.97 115.97 32.12 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.172 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.2 p -96.21 166.78 11.57 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 123.807 0.692 . . . . 0.0 109.944 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 36.4 p -64.27 -27.34 68.97 Favored 'General case' 0 C--O 1.249 1.075 0 CA-C-O 121.216 0.532 . . . . 0.0 110.087 177.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -54.59 -56.85 14.71 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 114.971 -1.013 . . . . 0.0 108.911 174.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.67 -40.13 92.08 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.167 -1.379 . . . . 0.0 111.122 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.53 -60.26 3.8 Favored 'General case' 0 C--O 1.212 -0.898 0 O-C-N 123.58 0.55 . . . . 0.0 110.49 175.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.6 -30.39 72.0 Favored Glycine 0 C--O 1.216 -1.02 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.773 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.6 m -68.98 -49.72 55.38 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.716 0.258 . . . . 0.0 110.915 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.565 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 27.1 m -66.91 -39.18 82.93 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.1 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -58.52 -45.48 88.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.532 0.52 . . . . 0.0 110.261 175.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -62.83 -35.41 79.84 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 123.255 0.622 . . . . 0.0 109.951 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 m -76.34 -12.93 60.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.814 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 97.4 mt -96.9 -17.68 19.99 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.169 177.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.8 32.11 9.47 Favored Glycine 0 C--N 1.311 -0.818 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.402 ' C ' HD21 ' A' ' 42' ' ' ASN . 63.7 tt0 -129.49 133.34 47.23 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.402 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -129.94 81.64 68.49 Favored Pre-proline 0 C--N 1.305 -1.363 0 O-C-N 121.034 -1.041 . . . . 0.0 113.596 -178.07 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -78.68 155.56 27.47 Favored 'Trans proline' 0 C--O 1.247 0.951 0 C-N-CA 122.13 1.887 . . . . 0.0 109.994 171.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.453 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 70.4 p -84.1 167.21 17.0 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.793 0.33 . . . . 0.0 111.757 -177.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -55.78 -45.73 78.09 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.506 1.122 . . . . 0.0 112.077 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.79 -41.98 92.38 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 120.766 0.317 . . . . 0.0 110.942 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -63.92 -48.33 77.02 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.476 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 44' ' ' THR . 91.1 mt -59.0 -42.65 90.59 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.231 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -69.78 -41.84 74.59 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -66.33 -35.92 81.6 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.436 0.636 . . . . 0.0 109.765 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.527 ' CG ' ' HD3' ' B' ' 98' ' ' PRO . 38.7 ttm -57.35 -39.97 77.05 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.593 1.557 . . . . 0.0 110.159 177.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 59.3 mt -74.27 -49.6 31.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.499 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.17 -31.0 62.99 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.383 -0.826 . . . . 0.0 113.02 -172.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -70.64 -11.36 60.89 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.549 HG13 ' SD ' ' A' ' 71' ' ' MET . 28.4 m -119.89 -18.19 6.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 O-C-N 122.403 -0.186 . . . . 0.0 110.863 174.085 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -70.13 107.72 3.8 Favored 'General case' 0 N--CA 1.444 -0.772 0 O-C-N 123.777 0.673 . . . . 0.0 111.076 -176.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.86 -9.86 54.77 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.602 -176.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.58 -11.63 20.82 Favored 'General case' 0 CA--C 1.493 -1.244 0 C-N-CA 119.964 -0.694 . . . . 0.0 110.503 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.63 41.95 99.07 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 -174.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.9 p-10 -114.3 -11.23 12.6 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.187 0.518 . . . . 0.0 110.867 -176.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.29 15.6 55.22 Favored Glycine 0 N--CA 1.431 -1.635 0 C-N-CA 120.82 -0.705 . . . . 0.0 114.418 173.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 11.9 p -137.52 147.11 44.93 Favored 'General case' 0 C--O 1.248 1.022 0 CA-C-N 117.812 0.806 . . . . 0.0 111.628 177.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.6 mt -99.68 110.53 27.05 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -84.58 -179.55 7.17 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.437 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 44.7 t80 -58.76 -53.93 61.36 Favored Pre-proline 0 C--N 1.311 -1.098 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -175.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.437 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.2 Cg_endo -52.98 -41.91 68.1 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.901 2.401 . . . . 0.0 111.757 176.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -67.25 -44.74 78.67 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.022 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.579 ' O ' ' HG2' ' A' ' 72' ' ' MET . 86.6 t80 -60.12 -41.82 93.45 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.049 0.539 . . . . 0.0 109.846 177.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.9 mt -65.09 -55.55 18.11 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.353 177.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 94.8 m -55.94 -41.43 74.63 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.417 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.549 ' SD ' HG13 ' A' ' 55' ' ' VAL . 20.0 ttp -55.65 -47.03 77.33 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.629 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.596 ' SD ' ' HA ' ' B' ' 99' ' ' TRP . 10.5 mmt -71.73 -41.31 68.66 Favored 'General case' 0 CA--C 1.486 -1.494 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.769 -176.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.5 -27.89 69.28 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.542 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -83.55 -30.59 26.94 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.453 0.644 . . . . 0.0 110.776 175.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -85.31 -3.29 58.78 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.895 0.855 . . . . 0.0 110.272 -173.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.517 ' HG3' ' O ' ' A' ' 72' ' ' MET . 61.7 mtt -77.5 91.77 3.96 Favored 'General case' 0 N--CA 1.429 -1.475 0 CA-C-O 121.947 0.88 . . . . 0.0 110.053 175.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -92.65 16.65 11.71 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.406 ' H ' ' C ' ' A' ' 76' ' ' MET . 34.2 t70 -59.39 119.01 6.66 Favored 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.756 -178.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.4 t -150.24 131.59 14.63 Favored 'General case' 0 N--CA 1.408 -2.572 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 175.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.5 t70 69.5 131.28 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.267 1.027 . . . . 0.0 111.753 -175.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.3 m -69.62 -22.0 63.52 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -173.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -102.89 -13.43 16.95 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.069 0.462 . . . . 0.0 111.049 -176.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -63.84 -33.52 75.88 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.938 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 34.3 tt0 -65.3 -31.1 72.07 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 122.106 0.955 . . . . 0.0 109.494 178.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.7 mm -81.42 -29.09 10.57 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 -175.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -78.73 -26.25 44.68 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.617 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.444 ' HB3' ' O ' ' A' ' 84' ' ' GLU . 41.2 tt0 -62.67 -54.87 32.88 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 172.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.45 -39.74 76.95 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 113.741 -1.572 . . . . 0.0 110.617 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -62.49 -46.32 88.97 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.49 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 78.5 mtm180 -68.02 -25.09 65.21 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 14.0 p -82.79 -19.72 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 120.196 -0.601 . . . . 0.0 110.633 178.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -91.84 -56.84 2.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -84.98 83.99 7.87 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 122.09 0.948 . . . . 0.0 109.155 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -78.84 -35.17 44.37 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.642 -177.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -72.16 -14.32 61.79 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.516 0.674 . . . . 0.0 110.581 -178.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.62 54.09 10.95 Favored Glycine 0 N--CA 1.431 -1.685 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.288 175.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -89.21 -18.56 26.85 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 121.02 0.438 . . . . 0.0 110.13 176.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.18 13.0 75.17 Favored Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -178.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -149.7 143.21 25.32 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.436 ' HB ' HG11 ' A' ' 136' ' ' VAL . 2.8 mt -87.84 109.68 19.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.8 m -80.18 140.04 36.51 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.47 -39.45 83.75 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 122.48 0.312 . . . . 0.0 111.416 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.81 -50.18 74.49 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.303 0.377 . . . . 0.0 111.497 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -70.51 -38.21 74.25 Favored 'General case' 0 CA--C 1.506 -0.749 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.787 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.47 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.5 tm? -59.58 -43.89 93.5 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.418 ' HA ' HG13 ' A' ' 121' ' ' VAL . 39.2 ttt180 -61.62 -45.13 95.4 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.536 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.5 m170 -59.87 -49.4 77.85 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.671 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.57 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -64.88 -33.36 63.03 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.385 0 C-N-CA 120.134 -0.626 . . . . 0.0 110.573 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.47 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.1 mmt -61.23 -41.94 97.75 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 120.887 0.375 . . . . 0.0 111.534 179.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 61.3 m -61.0 -38.51 86.29 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.217 176.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -76.73 -22.59 53.64 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.073 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 95.1 mt -88.95 -19.71 25.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.201 0.524 . . . . 0.0 110.541 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.36 0.55 55.71 Favored Glycine 0 N--CA 1.436 -1.336 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.162 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -70.62 -38.15 73.9 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.8 mttm 59.24 33.27 22.55 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.32 174.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 60.2 mt -64.52 138.25 58.3 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.621 -177.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 36.8 p -76.91 174.42 10.6 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.857 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -63.35 -44.32 95.15 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 116.9 -0.136 . . . . 0.0 111.263 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.415 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 1.4 mp0 -59.52 -37.6 78.76 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.78 -55.77 13.45 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.464 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.477 ' O ' HG12 ' A' ' 125' ' ' ILE . 11.4 m -64.21 -32.55 57.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.032 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -60.88 -45.74 93.39 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.688 0.795 . . . . 0.0 110.295 175.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -65.18 -43.32 92.06 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.184 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.515 ' HA ' ' CE2' ' B' ' 81' ' ' PHE . 54.1 mtt -56.54 -37.27 70.27 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.301 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.477 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.9 mm -76.22 -58.27 4.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -50.97 -44.83 60.76 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.935 1.294 . . . . 0.0 113.957 -173.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.544 ' HB3' ' CZ ' ' B' ' 81' ' ' PHE . 5.3 tp10 -83.54 -13.61 54.11 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 119.65 -0.82 . . . . 0.0 111.081 -174.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -96.76 -22.3 17.04 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.505 0.669 . . . . 0.0 109.582 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -72.7 92.53 1.56 Allowed 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.546 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 57.0 mt -82.41 -19.59 10.4 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.668 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.841 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -89.22 -12.06 41.88 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-O 121.408 0.623 . . . . 0.0 110.866 -173.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.09 36.7 60.36 Favored Glycine 0 N--CA 1.429 -1.771 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.2 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -95.3 -16.6 22.3 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.393 0.616 . . . . 0.0 109.438 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.29 13.19 82.22 Favored Glycine 0 CA--C 1.503 -0.705 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -175.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -151.09 144.73 25.01 Favored 'General case' 0 N--CA 1.418 -2.061 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 -176.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.436 HG11 ' HB ' ' A' ' 100' ' ' ILE . 2.4 p -97.27 112.21 28.8 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.99 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -172.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.447 ' HB3' ' OE2' ' A' ' 140' ' ' GLU . 45.1 t30 -76.38 162.62 27.72 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.825 178.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -56.21 -48.3 76.69 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 123.431 0.693 . . . . 0.0 112.374 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.435 ' HA ' HG23 ' A' ' 142' ' ' VAL . 41.3 mt-10 -66.65 -41.13 88.74 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.262 0.553 . . . . 0.0 111.422 -178.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.447 ' OE2' ' HB3' ' A' ' 137' ' ' ASN . 2.8 mp0 -56.78 -45.71 81.98 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.767 174.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -64.73 -50.84 65.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.843 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.435 HG23 ' HA ' ' A' ' 139' ' ' GLU . 24.2 m -62.43 -37.97 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -176.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -51.68 -59.51 4.21 Favored 'General case' 0 C--O 1.233 0.237 0 O-C-N 123.986 0.804 . . . . 0.0 110.482 -177.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.72 -26.68 44.81 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -172.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 2.6 tmm? -80.78 -33.85 34.6 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.275 -0.57 . . . . 0.0 110.959 -174.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 57.6 p -87.69 2.74 50.28 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.593 0.711 . . . . 0.0 110.629 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -82.81 50.51 1.71 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.949 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm . . . . . 0 C--O 1.247 0.93 0 C-N-CA 124.995 1.318 . . . . 0.0 110.01 -177.772 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 17.3 p . . . . . 0 N--CA 1.436 -1.137 0 N-CA-C 107.262 -1.385 . . . . 0.0 107.262 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo -46.34 -44.73 19.93 Favored 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 122.844 2.363 . . . . 0.0 110.606 177.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.95 179.14 8.72 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 172.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -154.4 98.68 2.13 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 173.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 2.7 p -82.03 22.81 0.75 Allowed 'General case' 0 C--N 1.299 -1.626 0 C-N-CA 124.348 1.059 . . . . 0.0 112.971 -175.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.424 ' C ' ' H ' ' B' ' 81' ' ' PHE . 98.4 m-85 67.05 163.78 0.19 Allowed 'General case' 0 C--O 1.24 0.6 0 C-N-CA 124.514 1.125 . . . . 0.0 112.33 -178.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 61.2 m170 70.74 -36.14 0.35 Allowed 'General case' 0 N--CA 1.504 2.239 0 C-N-CA 125.162 1.385 . . . . 0.0 113.073 -178.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . 0.544 ' CZ ' ' HB3' ' A' ' 127' ' ' GLU . 91.2 t80 -55.35 -41.08 72.04 Favored 'General case' 0 C--N 1.315 -0.935 0 C-N-CA 124.91 1.284 . . . . 0.0 112.007 -178.085 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -71.01 -36.74 72.54 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.949 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -69.55 -31.59 69.88 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.432 0.634 . . . . 0.0 109.334 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.453 ' HA ' ' CE1' ' B' ' 87' ' ' HIS . . . -61.98 -54.92 35.04 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.14 173.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 26.9 m95 -57.68 -40.96 80.61 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.341 175.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -54.72 -58.26 8.26 Favored 'General case' 0 CA--C 1.501 -0.934 0 C-N-CA 123.45 0.7 . . . . 0.0 110.169 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . 0.453 ' CE1' ' HA ' ' B' ' 84' ' ' ALA . 2.8 p-80 -65.49 -30.85 71.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.243 -0.583 . . . . 0.0 112.465 -179.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.08 -47.67 73.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.301 0.572 . . . . 0.0 110.061 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 85.4 mt -66.47 -36.66 77.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.73 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -59.01 -45.36 90.88 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -64.55 -43.87 92.59 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.271 175.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.18 -33.72 73.9 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.318 0.58 . . . . 0.0 110.983 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 22.6 mtpp -87.07 9.02 21.04 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.857 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 12.2 m80 -118.18 96.39 5.31 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.282 0.563 . . . . 0.0 111.917 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 27.5 ptm -85.27 -175.97 0.71 Allowed Pre-proline 0 C--N 1.301 -1.526 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 172.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.415 ' O ' ' HE2' ' A' ' 51' ' ' MET . 23.9 Cg_exo -68.43 76.54 0.72 Allowed 'Trans proline' 0 C--N 1.352 0.712 0 CA-C-N 121.888 1.71 . . . . 0.0 110.498 172.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -170.47 137.89 1.3 Allowed Pre-proline 0 C--N 1.312 -1.056 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 -177.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . 0.527 ' HD3' ' CG ' ' A' ' 51' ' ' MET . 1.3 Cg_endo -83.52 143.66 11.03 Favored 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.447 2.098 . . . . 0.0 113.413 -174.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . 0.596 ' HA ' ' SD ' ' A' ' 72' ' ' MET . 36.7 t-105 -140.72 -39.63 0.42 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 114.581 -1.19 . . . . 0.0 108.291 178.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.409 -2.523 1 N-CA-C 100.14 -4.022 . . . . 0.0 100.14 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.765 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -126.98 -39.5 1.94 Allowed 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 177.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -96.26 164.23 12.75 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 175.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.458 ' HB3' HD13 ' A' ' 9' ' ' ILE . 12.0 tp -126.68 151.44 48.09 Favored 'General case' 0 C--N 1.293 -1.874 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -174.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.9 p -82.59 152.94 25.72 Favored 'General case' 0 N--CA 1.428 -1.564 0 O-C-N 123.364 0.415 . . . . 0.0 110.9 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -53.53 -45.19 69.68 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -171.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.55 -37.91 88.09 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-O 120.733 0.301 . . . . 0.0 110.992 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.401 ' HB3' ' HE3' ' A' ' 76' ' ' MET . 5.8 mm-40 -72.76 -33.09 66.11 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.499 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 36.3 mt -66.08 -34.45 70.34 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.095 176.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.5 -37.78 80.39 Favored 'General case' 0 C--O 1.252 1.21 0 CA-C-O 121.815 0.817 . . . . 0.0 109.88 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -62.75 -40.08 96.13 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.155 176.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -79.75 -16.36 55.74 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 30.5 mmtp -61.92 -47.2 85.98 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 171.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -59.78 -52.95 63.26 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 114.285 -1.325 . . . . 0.0 110.327 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.94 82.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.76 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -65.78 -45.91 80.71 Favored 'General case' 0 C--O 1.206 -1.232 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.601 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 32.1 t -69.25 -23.74 63.9 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 120.732 0.301 . . . . 0.0 111.047 -177.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.292 1.0 OUTLIER -62.1 -57.03 13.09 Favored 'General case' 0 CA--C 1.476 -1.866 0 CA-C-O 123.196 1.474 . . . . 0.0 107.091 174.268 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.463 ' CZ ' HD21 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -74.43 -33.89 63.07 Favored 'General case' 1 N--CA 1.368 -4.564 0 CA-C-N 111.666 -2.515 . . . . 0.0 109.605 -167.72 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -78.19 84.38 4.41 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-O 122.235 1.017 . . . . 0.0 108.416 173.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.7 mmtm -67.75 -32.23 72.68 Favored 'General case' 0 N--CA 1.421 -1.908 0 CA-C-N 113.931 -1.486 . . . . 0.0 112.439 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -87.34 -13.48 43.44 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.919 -176.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.96 50.57 64.33 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 -177.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -113.4 -12.11 13.03 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -176.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.88 5.8 57.34 Favored Glycine 0 C--N 1.306 -1.128 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.309 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.8 p -143.04 145.62 33.07 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 117.758 0.779 . . . . 0.0 111.838 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.8 mt -95.46 118.02 40.74 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 69.6 p -100.79 169.5 8.96 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.139 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 77.8 p -63.31 -30.95 71.99 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 121.255 0.55 . . . . 0.0 109.995 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.1 tttm -50.04 -55.97 12.66 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.759 1.223 . . . . 0.0 109.348 175.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -67.65 -40.07 84.57 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.626 -176.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.463 HD21 ' CZ ' ' A' ' 19' ' ' PHE . 83.9 mt -54.17 -55.85 23.88 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.978 0.894 . . . . 0.0 109.498 177.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.76 -21.38 73.01 Favored Glycine 0 C--O 1.215 -1.093 0 CA-C-N 115.4 -0.818 . . . . 0.0 113.288 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.7 m -74.32 -48.27 29.32 Favored 'General case' 0 C--O 1.254 1.293 0 CA-C-N 117.497 0.648 . . . . 0.0 110.376 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 m -68.64 -32.81 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.451 ' HB3' ' HB3' ' A' ' 41' ' ' GLN . 41.1 mtm -73.26 -27.71 61.73 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -61.24 -39.69 91.25 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.0 m -63.46 -27.55 69.36 Favored 'General case' 0 CA--C 1.554 1.129 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.457 176.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.551 HD12 ' SD ' ' B' ' 95' ' ' MET . 2.4 tm? -88.88 -23.64 22.71 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.194 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 103.74 11.99 31.4 Favored Glycine 0 C--N 1.308 -1.026 0 C-N-CA 120.189 -1.005 . . . . 0.0 112.39 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.451 ' HB3' ' HB3' ' A' ' 36' ' ' MET . 2.4 tp-100 -101.28 125.01 47.86 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 179.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -125.87 75.26 71.2 Favored Pre-proline 0 C--N 1.294 -1.825 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.424 ' HG2' HD22 ' A' ' 48' ' ' LEU . 5.6 Cg_exo -77.64 147.91 25.39 Favored 'Trans proline' 0 N--CA 1.448 -1.164 0 C-N-CA 121.777 1.651 . . . . 0.0 109.977 176.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.5 p -68.56 154.02 42.66 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-O 120.533 0.206 . . . . 0.0 110.845 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -59.48 -30.57 68.63 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 122.801 0.44 . . . . 0.0 110.982 -177.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.27 78.54 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.338 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.428 ' O ' ' HG3' ' A' ' 51' ' ' MET . 55.2 mm-40 -65.97 -43.34 88.14 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.98 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.424 HD22 ' HG2' ' A' ' 43' ' ' PRO . 85.6 mt -67.43 -34.15 76.62 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.327 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.41 -44.77 90.19 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 178.181 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.56 -41.22 98.42 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.35 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.428 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 67.5 mtt -61.84 -42.53 99.14 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.084 178.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.9 mt -63.36 -45.07 99.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.998 0.428 . . . . 0.0 110.584 176.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -58.59 -18.28 28.8 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -175.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -64.82 -41.49 95.72 Favored 'General case' 0 N--CA 1.39 -3.472 0 O-C-N 121.783 -0.573 . . . . 0.0 110.051 177.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.584 HG13 ' SD ' ' A' ' 71' ' ' MET . 17.1 m -104.74 -17.33 7.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.429 -178.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -67.89 113.43 5.61 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -178.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.7 -23.73 36.61 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.229 0.537 . . . . 0.0 110.612 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -99.01 -11.89 21.1 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.399 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.52 51.55 57.12 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.642 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -115.22 -4.19 12.46 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 120.84 0.353 . . . . 0.0 111.906 -176.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.56 13.66 37.4 Favored Glycine 0 N--CA 1.438 -1.22 0 C-N-CA 120.829 -0.701 . . . . 0.0 113.299 174.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 11.2 p -141.48 139.55 33.35 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.882 0.341 . . . . 0.0 110.564 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 mt -91.47 113.25 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.941 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -83.85 166.19 18.13 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.455 ' CE2' HD13 ' A' ' 69' ' ' LEU . 56.5 t80 -56.79 -57.69 22.36 Favored Pre-proline 0 CA--C 1.555 1.145 0 O-C-N 123.568 0.543 . . . . 0.0 112.213 -177.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.17 -39.51 90.62 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.496 2.131 . . . . 0.0 112.539 177.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -63.4 -44.97 93.15 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.332 0.586 . . . . 0.0 110.287 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.63 -26.32 57.66 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.665 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.455 HD13 ' CE2' ' A' ' 65' ' ' PHE . 80.4 mt -63.98 -42.1 97.33 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 174.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.412 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 47.2 m -56.4 -48.69 76.4 Favored 'General case' 0 C--O 1.239 0.544 0 O-C-N 123.835 0.709 . . . . 0.0 109.152 175.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.584 ' SD ' HG13 ' A' ' 55' ' ' VAL . 40.4 ttp -54.65 -55.4 30.0 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.841 177.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 20.7 mmt -62.33 -38.62 90.16 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.4 -19.31 63.81 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 70' ' ' THR . 95.0 mtt180 -84.11 -29.86 26.42 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.23 0.538 . . . . 0.0 110.507 173.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -83.68 -33.74 25.12 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.803 0.811 . . . . 0.0 109.996 -176.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.401 ' HE3' ' HB3' ' A' ' 8' ' ' GLN . 34.9 ttm -84.42 122.67 29.29 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.842 -176.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 80.1 tttt 60.13 95.07 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.156 1.535 . . . . 0.0 111.582 171.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 79.31 123.59 0.05 OUTLIER 'General case' 0 CA--C 1.496 -1.133 0 C-N-CA 125.058 1.343 . . . . 0.0 111.73 -175.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.528 ' OG1' ' HA ' ' A' ' 82' ' ' GLU . 3.1 p -114.73 172.5 7.0 Favored 'General case' 0 C--N 1.277 -2.558 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.384 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -91.47 -44.91 8.83 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.839 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.6 m -120.22 14.26 12.13 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.297 0.57 . . . . 0.0 110.086 178.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.528 ' HA ' ' OG1' ' A' ' 79' ' ' THR . 10.6 mm-40 63.31 18.75 11.24 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.998 1.319 . . . . 0.0 110.88 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -60.34 -45.43 93.48 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.312 -1.313 . . . . 0.0 112.331 -175.715 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -59.52 -42.69 92.84 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 121.776 0.798 . . . . 0.0 110.356 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.0 mm -70.6 -42.87 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 CA-C-N 114.113 -1.403 . . . . 0.0 108.929 -173.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -71.16 -38.08 72.2 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.682 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 52.5 mt-10 -58.62 -46.82 86.24 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 175.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.76 -40.1 91.71 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.094 -179.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -65.44 -49.33 69.54 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.16 0.505 . . . . 0.0 109.966 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 24.5 ttp85 -58.35 -38.79 77.9 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.375 1.07 . . . . 0.0 112.432 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 9.6 p -75.97 -19.57 15.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.643 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -86.69 -50.81 6.52 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.453 174.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -95.59 76.46 3.28 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.947 0.879 . . . . 0.0 110.994 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -79.06 -29.4 43.44 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.542 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.99 -12.98 61.49 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.241 0.543 . . . . 0.0 111.457 -178.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.56 48.47 10.5 Favored Glycine 0 N--CA 1.435 -1.407 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.743 176.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -80.92 -19.91 43.24 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.23 -0.38 85.66 Favored Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 110.759 -0.937 . . . . 0.0 110.759 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.1 p90 -156.74 158.24 36.54 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -178.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.467 ' HB ' HG11 ' A' ' 136' ' ' VAL . 1.7 mt -87.41 106.09 15.84 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.3 t -93.82 143.71 26.09 Favored 'General case' 0 N--CA 1.422 -1.825 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.499 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.56 -38.99 92.93 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 123.218 0.607 . . . . 0.0 111.45 -177.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.7 -46.21 89.76 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.394 0.616 . . . . 0.0 109.981 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.569 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 2.8 tp10 -66.71 -45.64 78.08 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.392 176.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.99 -35.99 78.28 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -175.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.425 ' HB2' HG23 ' A' ' 121' ' ' VAL . 29.5 ttp180 -64.96 -36.2 83.63 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.296 177.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.569 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 42.9 m170 -56.72 -50.97 70.6 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.124 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.686 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.1 p -70.72 -33.06 51.31 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.838 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.36 -177.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 20.9 mmt -62.3 -46.72 87.48 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.3 m -65.23 -30.88 71.81 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.374 0.607 . . . . 0.0 109.498 177.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -71.89 -32.32 67.31 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.462 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.686 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 71.9 mt -85.47 -19.38 31.33 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 121.024 0.44 . . . . 0.0 110.69 -176.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.54 14.15 57.35 Favored Glycine 0 N--CA 1.434 -1.435 0 C-N-CA 120.56 -0.828 . . . . 0.0 111.606 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.42 ' OE1' ' HG3' ' B' ' 91' ' ' LYS . 30.9 mm-40 -74.48 -36.85 63.3 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 55.94 62.23 2.47 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 122.421 1.105 . . . . 0.0 110.78 178.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 71.2 mt -92.81 147.13 23.11 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.2 p -77.84 174.43 11.03 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 120.354 -0.538 . . . . 0.0 110.462 -179.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -68.37 -38.05 81.01 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.149 0.499 . . . . 0.0 109.705 -178.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 1.4 mp0 -63.45 -42.49 98.64 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 177.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -61.99 -54.85 35.96 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.437 1.095 . . . . 0.0 110.53 -177.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.425 HG23 ' HB2' ' A' ' 106' ' ' ARG . 25.3 m -63.39 -36.98 78.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.002 -177.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -72.18 -32.35 66.75 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.699 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -64.2 -47.58 79.21 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 mtt -51.68 -50.47 60.36 Favored 'General case' 0 CA--C 1.503 -0.844 0 O-C-N 123.601 0.563 . . . . 0.0 110.381 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.538 ' CG2' ' HA ' ' A' ' 135' ' ' GLN . 40.4 mm -60.11 -49.46 83.99 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.538 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.143 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.4 ttm180 -65.64 -30.82 71.58 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 123.298 0.639 . . . . 0.0 111.474 -175.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -78.03 -34.03 50.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.842 0.353 . . . . 0.0 110.683 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.13 -28.12 42.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.648 0.737 . . . . 0.0 109.282 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -74.84 94.4 2.77 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.681 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 9.6 mt -82.19 -19.06 10.81 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.804 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.151 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -82.62 -11.5 58.34 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.591 -173.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.3 24.06 72.06 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.177 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -87.11 -17.08 33.65 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.44 0.638 . . . . 0.0 109.768 -177.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 97.01 -18.62 57.2 Favored Glycine 0 N--CA 1.437 -1.277 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.192 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.538 ' HA ' ' CG2' ' A' ' 125' ' ' ILE . 31.8 mt-30 -134.44 147.33 50.41 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.467 HG11 ' HB ' ' A' ' 100' ' ' ILE . 1.7 p -94.76 124.03 47.1 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -173.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -93.4 175.4 6.77 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.548 ' O ' HG13 ' A' ' 142' ' ' VAL . 73.5 t80 -60.19 -45.69 92.26 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -175.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.628 ' O ' HG23 ' A' ' 142' ' ' VAL . 35.6 mm-40 -61.59 -43.58 98.6 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.331 0.586 . . . . 0.0 111.644 -179.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.14 -33.79 75.14 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.041 178.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -67.72 -38.97 84.3 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.998 176.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.628 HG23 ' O ' ' A' ' 139' ' ' GLU . 7.2 m -59.05 -38.53 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.46 -178.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -76.37 -41.46 48.01 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.617 -175.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 3.7 ppp? -76.52 -32.2 58.13 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.155 -0.618 . . . . 0.0 112.101 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.5 tpt -71.56 -26.0 62.44 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.114 0.483 . . . . 0.0 110.571 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 39.1 p -98.3 7.44 46.22 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.381 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.21 82.23 6.31 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-O 121.204 0.526 . . . . 0.0 111.275 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt . . . . . 0 N--CA 1.434 -1.269 0 CA-C-O 118.044 -0.979 . . . . 0.0 108.399 177.574 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 30.8 m . . . . . 0 N--CA 1.44 -0.964 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -71.96 -13.85 29.14 Favored 'Trans proline' 0 C--N 1.362 1.281 0 C-N-CA 123.021 2.48 . . . . 0.0 114.701 -175.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -119.69 -64.41 1.27 Allowed 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 177.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 59.5 t30 61.61 30.96 18.82 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.211 1.004 . . . . 0.0 110.212 175.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' SER . . . . . 0.482 ' O ' ' HB3' ' B' ' 81' ' ' PHE . 32.0 t -67.76 -33.63 75.23 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.508 1.123 . . . . 0.0 112.82 -173.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -76.58 -31.62 57.63 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.384 0.612 . . . . 0.0 109.858 -178.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -77.89 -28.84 49.97 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.538 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . 0.482 ' HB3' ' O ' ' B' ' 78' ' ' SER . 46.6 t80 -53.28 -42.35 66.48 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.786 1.235 . . . . 0.0 110.723 177.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp -63.41 -47.83 80.35 Favored 'General case' 0 N--CA 1.418 -2.04 0 C-N-CA 123.217 0.607 . . . . 0.0 110.747 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -58.92 -55.49 34.42 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.481 1.134 . . . . 0.0 108.675 176.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.03 -50.99 60.33 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 112.613 -2.085 . . . . 0.0 112.263 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -72.6 -28.6 62.88 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -58.84 -55.93 28.77 Favored 'General case' 0 CA--C 1.481 -1.693 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 172.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -46.66 -58.33 3.94 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 125.113 1.508 . . . . 0.0 111.333 175.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.12 -52.85 62.85 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 45.4 mm -65.14 -49.01 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-O 120.99 0.424 . . . . 0.0 110.102 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . 0.477 ' O ' ' HB2' ' B' ' 94' ' ' HIS . 7.9 tt0 -60.92 -37.35 81.98 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.968 0.907 . . . . 0.0 112.047 -176.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . 0.42 ' HG3' ' OE1' ' A' ' 114' ' ' GLU . 14.0 mmmm -81.73 -42.18 20.2 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . 0.461 ' C ' ' H ' ' B' ' 94' ' ' HIS . . . -77.95 -51.26 10.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.074 0.464 . . . . 0.0 111.588 -177.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.424 ' HE2' ' CB ' ' A' ' 87' ' ' GLU . 58.2 tttm -77.9 10.83 2.53 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.356 1.074 . . . . 0.0 110.321 -175.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . 0.477 ' HB2' ' O ' ' B' ' 90' ' ' GLN . 4.7 t60 -74.68 -7.6 53.75 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 125.699 1.599 . . . . 0.0 109.676 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.551 ' SD ' HD12 ' A' ' 39' ' ' LEU . 93.0 mmm -53.43 -55.74 31.62 Favored Pre-proline 0 CA--C 1.551 0.982 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.471 -179.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.467 ' HD3' ' HB2' ' B' ' 95' ' ' MET . 16.1 Cg_endo -101.22 44.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.365 1.402 0 C-N-CA 122.806 2.338 . . . . 0.0 109.755 177.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 15.3 t70 74.08 135.86 0.05 OUTLIER Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 125.804 1.642 . . . . 0.0 112.097 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -75.54 -14.49 19.99 Favored 'Trans proline' 0 C--O 1.255 1.355 0 C-N-CA 122.862 2.374 . . . . 0.0 114.57 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 65.7 m95 71.23 -46.52 0.64 Allowed 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 126.378 1.871 . . . . 0.0 111.943 -176.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.92 0 C-N-CA 125.785 1.634 . . . . 0.0 107.848 175.327 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.487 0 CA-C-O 120.647 0.26 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -134.19 156.04 49.06 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -126.38 36.45 4.49 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 176.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.443 ' HB3' HD13 ' A' ' 9' ' ' ILE . 11.1 tp -72.94 140.95 47.78 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.322 -173.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.5 p -82.65 153.76 25.24 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.255 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -53.62 -44.05 69.18 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 125.018 1.327 . . . . 0.0 110.959 -176.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -55.89 -49.01 74.6 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.107 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -68.57 -47.22 67.36 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.722 -178.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.615 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 60.3 mt -57.37 -40.24 73.02 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.464 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.329 -178.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.31 -49.03 79.38 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-O 120.792 0.33 . . . . 0.0 111.4 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -60.2 -41.18 92.43 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.637 0.732 . . . . 0.0 109.578 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.475 ' CE2' ' HG2' ' A' ' 72' ' ' MET . 36.5 m-85 -77.27 -13.62 59.9 Favored 'General case' 0 C--O 1.207 -1.156 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.615 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 97.7 mttt -69.64 -43.41 72.67 Favored 'General case' 0 C--O 1.249 1.059 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 173.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -64.64 -45.45 86.76 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.014 -0.993 . . . . 0.0 110.18 176.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.413 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -58.52 -47.88 82.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.356 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -57.03 -49.15 76.7 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.336 0.655 . . . . 0.0 111.196 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.3 m -76.99 -19.61 57.08 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.234 -174.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 15' ' ' ALA . 4.5 pp -79.21 -21.98 45.52 Favored 'General case' 0 CA--C 1.502 -0.9 0 C-N-CA 118.979 -1.088 . . . . 0.0 110.741 176.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.425 ' CE2' ' HA ' ' A' ' 32' ' ' LEU . 2.7 t80 -80.7 -50.85 9.37 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.46 79.72 3.17 Favored 'General case' 0 N--CA 1.416 -2.145 0 CA-C-N 113.012 -1.904 . . . . 0.0 110.47 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -54.58 -34.39 61.85 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 113.584 -1.644 . . . . 0.0 112.793 -175.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -92.87 -8.18 44.12 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.734 -170.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.5 37.12 94.02 Favored Glycine 0 C--O 1.235 0.208 0 C-N-CA 121.344 -0.455 . . . . 0.0 112.626 177.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -100.87 -16.2 17.32 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 122.755 -0.262 . . . . 0.0 111.288 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.5 6.96 76.59 Favored Glycine 0 N--CA 1.439 -1.126 0 C-N-CA 120.554 -0.831 . . . . 0.0 114.4 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.8 p -128.68 130.69 47.53 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 118.063 0.931 . . . . 0.0 109.737 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 51.2 mt -96.15 122.01 47.24 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.477 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.4 p -101.86 168.32 9.5 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.037 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -64.84 -27.74 69.08 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.131 0.491 . . . . 0.0 110.496 177.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -57.47 -57.16 13.87 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 177.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.49 -37.9 89.16 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 114.543 -1.208 . . . . 0.0 111.834 -176.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 28' ' ' THR . 96.4 mt -52.85 -62.84 1.39 Allowed 'General case' 0 CA--C 1.501 -0.932 0 O-C-N 124.237 0.961 . . . . 0.0 109.85 178.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.07 -28.52 71.56 Favored Glycine 0 N--CA 1.428 -1.861 0 C-N-CA 119.875 -1.155 . . . . 0.0 113.268 -176.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.3 m -60.82 -55.36 34.01 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 118.105 0.953 . . . . 0.0 111.007 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.69 -35.05 30.12 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.746 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.3 mtp -64.98 -37.29 87.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.419 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -64.85 -40.77 95.68 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 122.703 0.401 . . . . 0.0 110.027 176.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.4 m -65.4 -26.82 68.16 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.371 0.605 . . . . 0.0 110.339 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -94.72 8.98 40.68 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.785 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.407 ' HA3' ' HA3' ' A' ' 113' ' ' GLY . . . 87.03 35.54 9.72 Favored Glycine 0 C--N 1.312 -0.786 0 C-N-CA 120.032 -1.08 . . . . 0.0 115.719 172.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -143.16 121.78 12.53 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 172.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.428 ' N ' HD21 ' A' ' 42' ' ' ASN . 0.7 OUTLIER -116.06 84.49 13.71 Favored Pre-proline 0 C--N 1.309 -1.183 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.723 -178.884 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.439 ' HG2' HD21 ' A' ' 48' ' ' LEU . 19.1 Cg_endo -84.47 169.22 11.07 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.386 2.058 . . . . 0.0 111.655 176.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.0 p -96.48 170.3 9.31 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.848 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -56.49 -42.48 78.36 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.55 1.14 . . . . 0.0 110.368 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.24 -47.77 84.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.364 -178.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -63.73 -43.69 95.74 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.361 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.439 HD21 ' HG2' ' A' ' 43' ' ' PRO . 94.1 mt -62.7 -34.09 76.42 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.709 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -72.58 -34.39 67.42 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.69 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -65.68 -42.26 91.46 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.2 mtt -55.28 -42.84 74.1 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.655 177.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 33.3 mt -71.16 -56.52 10.27 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.612 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.815 176.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -54.22 -31.04 52.15 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -174.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.94 -42.5 89.96 Favored 'General case' 0 N--CA 1.415 -2.19 0 C-N-CA 124.009 0.924 . . . . 0.0 110.744 175.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.53 HG11 ' SD ' ' A' ' 71' ' ' MET . 9.5 m -102.84 -18.9 6.37 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.194 -175.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -68.63 109.7 3.9 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.56 -40.33 21.06 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.041 -173.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -94.44 -9.91 34.07 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.143 -176.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.88 53.24 31.83 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.977 177.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.2 p-10 -107.6 -9.71 15.82 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 120.65 -0.42 . . . . 0.0 111.241 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 106.95 -0.05 35.94 Favored Glycine 0 N--CA 1.439 -1.159 0 C-N-CA 120.386 -0.911 . . . . 0.0 113.306 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.5 p -135.27 151.33 50.47 Favored 'General case' 0 C--O 1.249 1.068 0 CA-C-N 117.609 0.705 . . . . 0.0 111.888 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.1 mt -93.71 110.34 23.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 175.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -82.49 175.11 10.47 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 177.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 59.8 t80 -61.08 -52.9 68.56 Favored Pre-proline 0 C--N 1.302 -1.487 0 CA-C-O 119.255 -0.403 . . . . 0.0 111.484 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.9 Cg_endo -53.02 -34.94 69.89 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.769 2.313 . . . . 0.0 112.522 174.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -74.39 -39.87 62.4 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -61.85 -42.54 99.17 Favored 'General case' 0 C--O 1.246 0.889 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 76.3 mt -60.47 -46.55 89.66 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.022 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.2 m -57.89 -42.22 84.18 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 123.52 0.512 . . . . 0.0 110.853 177.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.53 ' SD ' HG11 ' A' ' 55' ' ' VAL . 30.6 ttp -57.79 -45.92 85.35 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 121.021 0.439 . . . . 0.0 111.451 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.475 ' HG2' ' CE2' ' A' ' 12' ' ' PHE . 34.6 tpp -76.3 -33.74 59.06 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.222 -176.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.35 -21.73 62.0 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.745 -179.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -83.64 -27.49 29.09 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 121.549 0.69 . . . . 0.0 109.663 173.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -86.39 -38.66 17.17 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.302 -173.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.406 ' HG2' ' OE1' ' A' ' 84' ' ' GLU . 32.5 mtm -99.11 -30.81 12.09 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.99 -178.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -119.34 176.59 5.26 Favored 'General case' 0 N--CA 1.414 -2.268 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 -172.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 35.9 t70 67.32 20.37 10.03 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 123.676 1.703 . . . . 0.0 108.33 -174.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.5 t -163.43 127.39 2.82 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-N 112.901 -1.954 . . . . 0.0 107.394 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -118.12 -25.08 6.77 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -173.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.9 m -88.42 71.65 8.99 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -171.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 53.63 41.99 31.96 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 114.082 -1.417 . . . . 0.0 113.183 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -60.46 -62.73 1.65 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.406 ' OE1' ' HG2' ' A' ' 76' ' ' MET . 45.3 mt-10 -67.04 -35.09 79.12 Favored 'General case' 0 CA--C 1.485 -1.539 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.315 -178.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 26.8 mm -61.13 -46.02 97.44 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.408 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.1 ttp-105 -67.97 -50.16 57.37 Favored 'General case' 0 C--O 1.196 -1.745 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.032 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -55.49 -39.2 70.12 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.5 86.81 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 120.501 0.191 . . . . 0.0 111.132 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -71.57 -49.15 43.28 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -56.59 -32.5 65.29 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 126.521 1.929 . . . . 0.0 112.485 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.52 -28.63 16.11 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 C-N-CA 120.197 -0.601 . . . . 0.0 111.304 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -81.6 -47.64 12.78 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 174.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -83.84 61.74 6.55 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 122.974 1.369 . . . . 0.0 107.452 175.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -77.84 -24.03 48.76 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.415 -172.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -93.49 -13.34 27.97 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.497 0.665 . . . . 0.0 110.359 -177.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.2 62.85 1.46 Allowed Glycine 0 N--CA 1.435 -1.372 0 C-N-CA 120.494 -0.86 . . . . 0.0 111.589 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -106.02 -19.26 13.78 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-O 121.587 0.708 . . . . 0.0 109.246 177.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.08 -13.38 59.73 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.672 175.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -139.7 132.32 28.84 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -176.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.459 ' HB ' HG11 ' A' ' 136' ' ' VAL . 3.7 mt -80.37 121.82 34.48 Favored 'Isoleucine or valine' 0 C--O 1.252 1.225 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.4 m -101.19 161.73 13.4 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 123.349 0.406 . . . . 0.0 109.978 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.12 -52.89 20.1 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -172.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.33 -29.98 69.68 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 121.73 0.776 . . . . 0.0 109.226 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.18 -39.85 93.44 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.307 -1.315 . . . . 0.0 110.499 175.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' A' ' 109' ' ' MET . 4.9 tt -64.85 -45.79 84.61 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 177.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.416 ' HG3' HG23 ' A' ' 121' ' ' VAL . 51.0 mtp180 -61.35 -35.67 78.06 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.919 -0.488 . . . . 0.0 111.67 175.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -61.37 -51.56 68.29 Favored 'General case' 0 C--O 1.259 1.587 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.818 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.618 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 10.5 p -65.59 -35.41 75.17 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.635 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.911 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.0 mmt -60.75 -40.18 91.5 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 56.8 m -59.87 -40.9 90.22 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 176.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -72.96 -26.82 61.51 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.491 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 81.8 mt -86.56 -7.45 58.36 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.166 0.507 . . . . 0.0 109.901 -178.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . 0.407 ' HA3' ' HA3' ' A' ' 40' ' ' GLY . . . 70.37 13.6 70.91 Favored Glycine 0 N--CA 1.432 -1.586 0 CA-C-N 115.085 -0.961 . . . . 0.0 113.168 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -86.84 -35.4 19.08 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp 57.15 94.78 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.307 1.043 . . . . 0.0 111.954 176.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 72.0 mt -110.91 155.86 22.03 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 120.894 0.378 . . . . 0.0 111.292 -176.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.0 p -85.37 161.12 19.6 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.607 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -64.26 -41.14 97.08 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -69.06 -33.36 73.45 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.646 0.736 . . . . 0.0 110.307 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -68.15 -51.59 44.19 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.583 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.416 HG23 ' HG3' ' A' ' 106' ' ' ARG . 16.7 m -67.79 -30.57 48.9 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.429 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.325 178.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.93 -44.01 90.89 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.299 178.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.97 -43.67 98.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 65.4 mtt -56.65 -55.0 39.58 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 124.01 0.819 . . . . 0.0 111.038 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 46.2 mm -58.11 -55.37 22.52 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.416 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.724 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 -58.14 -43.15 87.17 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 113.186 0.809 . . . . 0.0 113.186 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -76.09 -28.43 57.56 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.396 -176.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -80.12 -28.78 38.92 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.691 0.758 . . . . 0.0 110.076 177.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -76.42 85.45 3.16 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 122.118 0.961 . . . . 0.0 110.664 178.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.0 mt -78.01 -23.29 13.79 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.903 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -83.19 -10.97 58.3 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.907 0.384 . . . . 0.0 111.134 -175.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.34 37.55 70.6 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -94.97 -16.89 22.43 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 121.647 0.737 . . . . 0.0 109.417 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 97.47 -14.75 63.02 Favored Glycine 0 N--CA 1.444 -0.825 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -177.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -133.98 138.36 45.38 Favored 'General case' 0 CA--C 1.49 -1.361 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 178.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.459 HG11 ' HB ' ' A' ' 100' ' ' ILE . 0.7 OUTLIER -80.75 121.46 34.26 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 CA-C-O 121.183 0.516 . . . . 0.0 111.815 -177.904 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.566 ' HB3' ' OE2' ' A' ' 140' ' ' GLU . 50.8 t30 -87.99 166.67 14.32 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.925 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.529 ' O ' HG13 ' A' ' 142' ' ' VAL . 91.1 t80 -61.07 -45.44 94.71 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 123.223 0.609 . . . . 0.0 112.318 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.478 ' O ' HG22 ' A' ' 142' ' ' VAL . 15.1 mm-40 -65.41 -40.86 93.89 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.282 0.563 . . . . 0.0 111.732 -178.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.566 ' OE2' ' HB3' ' A' ' 137' ' ' ASN . 4.8 mp0 -60.54 -43.62 97.0 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.272 175.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -60.09 -47.04 87.55 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.881 176.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.529 HG13 ' O ' ' A' ' 138' ' ' TYR . 4.4 m -63.6 -39.2 84.47 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.491 -178.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -65.49 -42.5 92.1 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.042 -176.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.475 ' HG3' ' N ' ' A' ' 145' ' ' MET . 3.4 ptm -78.62 -37.55 41.94 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 119.937 -0.705 . . . . 0.0 111.726 -178.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.475 ' N ' ' HG3' ' A' ' 144' ' ' MET . 3.0 tmm? -72.87 -38.23 67.08 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.999 -171.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 15.5 m -81.08 -28.03 35.41 Favored 'General case' 0 C--N 1.308 -1.203 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.798 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -95.92 80.65 3.35 Favored 'General case' 0 C--N 1.316 -0.872 0 O-C-N 121.681 -0.637 . . . . 0.0 110.534 178.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.3 mttp . . . . . 0 C--N 1.307 -1.255 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.078 179.898 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.428 -1.555 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -58.46 -46.44 24.35 Favored 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 122.473 2.115 . . . . 0.0 111.562 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -83.81 74.43 10.19 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.99 0.9 . . . . 0.0 110.433 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -153.94 35.69 0.44 Allowed 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -41.17 -71.83 0.07 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.949 1.7 . . . . 0.0 115.207 -172.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -107.97 61.4 0.61 Allowed 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 176.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 60.34 26.71 16.24 Favored 'General case' 0 C--O 1.208 -1.097 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.861 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -42.91 -52.29 5.2 Favored 'General case' 0 C--O 1.21 -1.005 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -77.6 -27.1 51.19 Favored 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 119.522 -0.871 . . . . 0.0 112.341 -175.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -73.54 -43.06 60.84 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 176.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.68 -34.86 65.07 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.857 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -73.43 -36.11 65.89 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -58.57 -53.88 53.39 Favored 'General case' 0 CA--C 1.493 -1.214 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 174.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -57.52 -40.19 78.18 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 114.553 -1.203 . . . . 0.0 112.756 176.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.85 -54.72 38.29 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 122.46 0.304 . . . . 0.0 111.382 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.577 ' O ' ' HB3' ' B' ' 93' ' ' LYS . 44.3 pt -64.33 -35.82 75.29 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 CA-C-O 120.941 0.4 . . . . 0.0 110.611 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . 0.6 ' O ' ' HB3' ' B' ' 94' ' ' HIS . 7.9 tt0 -69.59 -41.16 76.15 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.421 179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' B' ' 95' ' ' MET . 23.4 tptm -65.34 -45.49 84.02 Favored 'General case' 0 C--O 1.205 -1.248 0 C-N-CA 122.701 0.401 . . . . 0.0 110.508 -177.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.6 -47.55 11.97 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -175.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.577 ' HB3' ' O ' ' B' ' 89' ' ' ILE . 0.3 OUTLIER -74.5 -5.53 43.17 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-O 121.529 0.68 . . . . 0.0 112.083 -177.435 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . 0.6 ' HB3' ' O ' ' B' ' 90' ' ' GLN . 26.8 t60 -137.38 24.24 2.95 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.819 0.819 . . . . 0.0 109.522 -178.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.465 ' HB2' ' O ' ' B' ' 91' ' ' LYS . 53.2 ttp -68.36 -53.08 18.96 Favored Pre-proline 0 CA--C 1.552 1.036 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.46 27.23 0.59 Allowed 'Trans proline' 0 C--N 1.368 1.569 0 C-N-CA 121.902 1.735 . . . . 0.0 113.022 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -125.61 168.09 14.78 Favored Pre-proline 0 C--N 1.305 -1.345 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 177.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_exo -60.11 110.1 0.72 Allowed 'Trans proline' 0 C--O 1.244 0.803 0 N-CA-C 107.558 -1.747 . . . . 0.0 107.558 168.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 14.2 t90 -76.64 84.92 3.3 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -170.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.287 -2.152 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 174.813 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.635 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -133.34 24.82 4.15 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.521 ' OE1' ' HG2' ' A' ' 77' ' ' LYS . 88.9 mt-30 -74.5 85.43 2.03 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.535 0.683 . . . . 0.0 112.741 -175.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 tp -133.11 111.41 10.91 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 45.5 p -80.73 156.2 26.36 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.869 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -57.22 -33.33 67.43 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 123.45 0.7 . . . . 0.0 112.345 -174.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 2.0 mp0 -61.01 -46.2 91.73 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.022 0.915 . . . . 0.0 109.293 178.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.457 ' O ' ' HB3' ' A' ' 11' ' ' GLU . 62.0 tt0 -75.08 -33.17 61.62 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 114.623 -1.172 . . . . 0.0 110.14 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.618 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 67.3 mt -63.98 -37.32 79.5 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.57 -40.89 88.83 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 122.631 0.372 . . . . 0.0 110.725 175.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.457 ' HB3' ' O ' ' A' ' 8' ' ' GLN . 10.3 tp10 -57.13 -50.75 71.84 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 174.6 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -62.68 -30.27 71.27 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.936 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.618 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 91.1 mttt -62.14 -48.26 80.89 Favored 'General case' 0 C--O 1.252 1.224 0 CA-C-O 121.243 0.544 . . . . 0.0 110.477 179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -71.98 -43.73 64.66 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.103 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.56 -48.58 74.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.927 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.54 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 56.7 t80 -58.15 -55.34 36.28 Favored 'General case' 0 C--O 1.189 -2.098 0 C-N-CA 124.082 0.953 . . . . 0.0 110.425 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.9 m -68.72 -17.02 63.99 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 123.402 0.438 . . . . 0.0 111.677 -174.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.87 -43.25 84.05 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 174.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.51 ' CE2' ' HB3' ' B' ' 98' ' ' PRO . 35.2 p90 -96.6 -24.06 16.21 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 119.713 -0.795 . . . . 0.0 111.945 -178.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -79.18 81.55 5.43 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 168.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -58.45 -31.43 67.77 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.466 -1.697 . . . . 0.0 114.241 -169.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.414 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 34.3 m-20 -88.05 -13.0 42.66 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.311 -0.956 . . . . 0.0 111.845 178.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.94 61.09 6.77 Favored Glycine 0 CA--C 1.518 0.233 0 O-C-N 123.285 0.365 . . . . 0.0 112.318 -179.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.414 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 5.3 m-20 -111.09 -16.8 13.39 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.108 0.48 . . . . 0.0 109.889 -175.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.8 13.87 64.02 Favored Glycine 0 C--O 1.215 -1.087 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -174.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.599 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 17.2 p -143.41 138.42 29.34 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 122.989 0.516 . . . . 0.0 109.973 177.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mt -104.81 127.7 59.08 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 177.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.7 p -98.86 171.55 8.0 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.1 p -58.93 -39.41 81.49 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 120.984 0.421 . . . . 0.0 110.502 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -50.66 -55.1 17.98 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.014 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -66.82 -44.29 81.53 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.755 -174.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 75.6 mt -53.6 -51.68 62.26 Favored 'General case' 0 CA--C 1.51 -0.579 0 O-C-N 123.851 0.719 . . . . 0.0 111.105 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.532 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -72.9 -37.02 57.09 Favored Glycine 0 C--O 1.192 -2.471 0 C-N-CA 119.25 -1.452 . . . . 0.0 112.832 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.2 m -58.73 -48.36 81.44 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-N 118.593 1.196 . . . . 0.0 110.716 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.464 HG13 ' HB2' ' A' ' 19' ' ' PHE . 17.0 m -67.59 -34.71 69.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.31 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.3 mtm -73.37 -37.0 66.18 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 31.2 mtm180 -66.43 -30.31 70.64 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.7 m -71.74 -30.68 65.88 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.496 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.7 mt -84.07 -15.18 48.36 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.816 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.5 37.1 1.97 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.697 -0.764 . . . . 0.0 114.633 175.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -148.42 131.17 16.0 Favored 'General case' 0 CA--C 1.503 -0.858 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 173.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -114.98 80.36 6.74 Favored Pre-proline 0 C--N 1.31 -1.133 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.639 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -76.12 154.44 37.33 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.154 1.903 . . . . 0.0 110.688 175.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.591 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 51.8 p -83.31 164.05 20.29 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -178.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -66.56 -27.1 67.47 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 -177.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.24 -45.13 91.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.313 0.577 . . . . 0.0 109.685 175.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' A' ' 51' ' ' MET . 34.5 mt-10 -67.49 -48.3 67.51 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.621 178.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 44' ' ' THR . 73.9 mt -57.27 -41.32 79.46 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.162 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 -70.42 -35.59 73.51 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.02 -178.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.47 -41.01 85.3 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.624 ' HB3' ' SD ' ' B' ' 95' ' ' MET . 66.4 mtt -54.89 -46.07 74.77 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.194 176.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 67.6 mt -67.19 -55.11 18.82 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.778 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.311 178.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -55.72 -32.64 63.52 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -171.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -61.73 -36.75 81.88 Favored 'General case' 0 N--CA 1.385 -3.707 0 C-N-CA 123.408 0.683 . . . . 0.0 112.587 178.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.447 HG13 ' SD ' ' A' ' 71' ' ' MET . 34.5 m -98.43 -13.95 7.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-O 120.909 0.385 . . . . 0.0 110.149 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -79.21 105.61 10.66 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.89 -177.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.49 -9.31 56.48 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.964 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.17 -11.8 31.88 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.197 -176.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.99 37.59 91.68 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.799 -176.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -115.17 -14.96 11.71 Favored 'General case' 0 C--N 1.32 -0.712 0 O-C-N 122.673 -0.31 . . . . 0.0 111.248 -176.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.23 23.16 32.78 Favored Glycine 0 N--CA 1.433 -1.517 0 C-N-CA 120.438 -0.886 . . . . 0.0 113.385 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.7 p -133.57 136.74 45.12 Favored 'General case' 0 C--O 1.252 1.203 0 CA-C-N 117.37 0.585 . . . . 0.0 111.379 178.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.599 ' O ' ' HA ' ' A' ' 26' ' ' THR . 51.2 mt -91.69 110.74 23.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.121 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -75.35 154.9 37.01 Favored 'General case' 0 C--N 1.279 -2.461 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.415 ' CZ ' ' HG2' ' A' ' 13' ' ' LYS . 63.1 t80 -51.41 -51.62 67.27 Favored Pre-proline 0 C--N 1.311 -1.093 0 O-C-N 123.422 0.451 . . . . 0.0 111.668 176.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.2 Cg_endo -49.98 -40.74 49.52 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.707 2.272 . . . . 0.0 112.397 172.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -69.6 -40.64 76.54 Favored 'General case' 0 C--O 1.22 -0.449 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.545 ' CE1' ' HE1' ' A' ' 72' ' ' MET . 38.4 t80 -58.55 -40.49 83.17 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.205 0.602 . . . . 0.0 109.563 174.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 94.1 mt -64.94 -51.6 60.93 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.747 176.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 74.3 m -57.04 -45.87 82.84 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.826 0.45 . . . . 0.0 111.018 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.447 ' SD ' HG13 ' A' ' 55' ' ' VAL . 26.9 ttp -58.68 -44.09 90.15 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.49 0.716 . . . . 0.0 111.642 178.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.545 ' HE1' ' CE1' ' A' ' 68' ' ' PHE . 2.5 tpp -74.61 -36.3 62.95 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.153 -177.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.22 -48.57 80.86 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.269 177.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -70.12 -16.44 63.11 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.409 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -88.82 -16.25 32.52 Favored 'General case' 0 C--N 1.297 -1.716 0 C-N-CA 123.032 0.533 . . . . 0.0 111.632 178.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.9 ttp -116.48 -64.36 1.32 Allowed 'General case' 0 C--O 1.244 0.812 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 -167.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.521 ' HG2' ' OE1' ' A' ' 3' ' ' GLN . 84.0 tttt -127.07 132.42 50.67 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -166.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 25.5 t70 80.7 10.47 1.04 Allowed 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 127.105 2.162 . . . . 0.0 106.231 -169.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 90.3 m -102.08 143.17 32.25 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 111.901 -2.409 . . . . 0.0 110.319 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.526 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 43.6 m-20 80.71 82.7 0.04 OUTLIER 'General case' 0 CA--C 1.496 -1.122 0 C-N-CA 124.646 1.178 . . . . 0.0 113.231 172.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.9 p -113.11 -60.96 1.81 Allowed 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -141.51 -58.09 0.48 Allowed 'General case' 0 N--CA 1.418 -2.031 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.134 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -68.85 -38.46 79.81 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.76 -173.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.526 ' HB2' ' HA ' ' A' ' 80' ' ' ASP . 42.8 mm-40 -56.76 -38.21 72.14 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.214 0.53 . . . . 0.0 110.058 175.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.432 ' CD1' ' HG2' ' A' ' 145' ' ' MET . 15.0 mm -68.2 -46.83 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.693 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.5 ttm180 -71.02 -29.73 65.74 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 114.314 -1.312 . . . . 0.0 112.588 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -68.06 -44.47 76.27 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.504 0.669 . . . . 0.0 109.625 174.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.453 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -68.52 -24.29 64.63 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.741 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -81.46 -42.01 20.95 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 121.121 0.486 . . . . 0.0 109.903 176.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -57.39 -33.23 67.62 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.072 1.349 . . . . 0.0 112.612 -177.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.453 HG12 ' O ' ' A' ' 88' ' ' ALA . 11.6 p -58.42 -31.08 42.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.255 178.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.427 ' HB3' HG21 ' A' ' 100' ' ' ILE . 61.2 m-85 -93.86 -60.93 1.64 Allowed 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -85.79 87.19 7.37 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 122.313 1.054 . . . . 0.0 110.149 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -78.51 -39.89 36.77 Favored 'General case' 0 C--N 1.288 -2.077 0 CA-C-N 113.399 -1.728 . . . . 0.0 111.259 -175.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -79.79 -13.15 59.63 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.919 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.87 50.88 5.35 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.309 -0.948 . . . . 0.0 110.921 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -97.9 -12.63 21.86 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-O 121.268 0.556 . . . . 0.0 109.835 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.4 ' O ' ' HA ' ' A' ' 137' ' ' ASN . . . 78.79 20.42 70.95 Favored Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.935 176.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.412 ' HA ' ' O ' ' A' ' 136' ' ' VAL . 21.8 p90 -150.52 154.89 38.43 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 117.037 0.418 . . . . 0.0 110.669 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.455 ' HB ' HG11 ' A' ' 136' ' ' VAL . 4.2 mt -110.65 137.62 42.27 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 177.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 14.8 m -116.69 154.72 30.09 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 123.973 0.796 . . . . 0.0 109.507 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.71 -44.15 82.43 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -175.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.68 -49.16 76.23 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.643 0.258 . . . . 0.0 110.945 -178.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -55.42 -46.62 76.65 Favored 'General case' 0 CA--C 1.501 -0.928 0 C-N-CA 123.164 0.586 . . . . 0.0 110.33 176.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.4 tt -59.16 -44.65 92.14 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-N 115.087 -0.96 . . . . 0.0 108.899 -173.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.49 ' HG3' HG23 ' A' ' 121' ' ' VAL . 33.0 mtp180 -62.29 -37.19 84.58 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 120.977 0.418 . . . . 0.0 111.805 174.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -60.96 -44.94 96.59 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.663 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 8.9 p -72.84 -31.39 36.09 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.213 0 C-N-CA 119.71 -0.796 . . . . 0.0 110.375 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.8 mmt -64.22 -44.73 90.98 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-O 120.57 0.224 . . . . 0.0 111.433 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 22.2 m -61.41 -33.55 73.88 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.245 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -75.21 -31.58 60.94 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.918 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.9 mt -81.88 -18.36 44.06 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.647 0.737 . . . . 0.0 109.904 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 86.09 21.93 50.62 Favored Glycine 0 N--CA 1.433 -1.552 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.54 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -101.6 122.28 43.56 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -83.16 107.88 16.03 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 123.475 0.484 . . . . 0.0 110.135 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 20.8 mt -124.97 152.13 44.57 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 176.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 50.9 p -87.06 174.5 8.62 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -71.65 -30.09 65.35 Favored 'General case' 0 C--O 1.207 -1.134 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 175.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.9 -49.45 77.41 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.559 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -56.86 -55.22 37.22 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.166 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.49 HG23 ' HG3' ' A' ' 106' ' ' ARG . 11.3 m -68.5 -32.0 53.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.372 -175.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -67.42 -44.9 77.65 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -63.87 -39.7 94.81 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 123.472 0.483 . . . . 0.0 110.337 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.3 mtt -52.6 -54.16 36.81 Favored 'General case' 0 CA--C 1.499 -0.989 0 O-C-N 124.133 0.896 . . . . 0.0 110.452 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mm -65.39 -55.73 18.75 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.192 0 O-C-N 123.777 0.673 . . . . 0.0 110.448 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 50.7 ttt180 -49.06 -47.07 45.25 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 125.145 1.378 . . . . 0.0 113.989 -173.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.52 ' HB3' ' CZ ' ' B' ' 81' ' ' PHE . 7.9 tp10 -82.8 -27.2 31.11 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.665 -177.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.86 -19.96 47.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 122.309 1.052 . . . . 0.0 109.454 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.23 74.51 1.3 Allowed 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.643 176.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.1 mt -75.89 -14.65 15.22 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 CA-C-N 114.342 -1.299 . . . . 0.0 107.922 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -81.66 -10.29 59.44 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.695 -1.139 . . . . 0.0 109.788 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 59.97 31.34 72.15 Favored Glycine 0 C--N 1.34 0.773 0 CA-C-N 115.013 -0.994 . . . . 0.0 113.757 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -115.42 -11.72 11.81 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 121.531 0.681 . . . . 0.0 111.15 -173.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 94.81 14.78 48.34 Favored Glycine 0 C--N 1.304 -1.201 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -177.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -143.71 124.51 14.22 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.455 HG11 ' HB ' ' A' ' 100' ' ' ILE . 0.9 OUTLIER -88.79 112.86 24.62 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.88 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.988 179.203 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.4 ' HA ' ' O ' ' A' ' 98' ' ' GLY . 48.4 m-80 -81.84 160.99 23.37 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.939 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -57.24 -42.36 81.3 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.692 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -62.22 -21.58 65.25 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -87.87 -44.91 10.72 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -62.97 -38.45 91.16 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.376 -1.284 . . . . 0.0 112.609 -177.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 25.5 m -57.14 -30.43 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-O 121.18 0.515 . . . . 0.0 111.982 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -79.28 -26.38 42.35 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 121.495 0.664 . . . . 0.0 111.178 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 85.5 mtp -80.06 -19.13 48.26 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.898 -175.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.432 ' HG2' ' CD1' ' A' ' 85' ' ' ILE . 58.4 tpp -62.98 -22.71 67.02 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -176.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 14.0 t -81.0 -2.97 50.08 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.196 -177.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -93.51 19.73 8.11 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 121.757 0.789 . . . . 0.0 110.119 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt . . . . . 0 C--N 1.302 -1.491 0 CA-C-N 113.579 -1.646 . . . . 0.0 112.838 -178.112 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.439 -1.02 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.54 -29.11 77.34 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 122.94 2.427 . . . . 0.0 112.813 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.08 22.0 2.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.882 -178.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 38.6 p30 -66.37 -18.74 65.54 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 19.1 m -90.36 15.84 9.85 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-O 121.099 0.476 . . . . 0.0 109.932 176.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 49.59 -87.98 0.01 OUTLIER 'General case' 0 C--O 1.246 0.907 0 C-N-CA 126.413 1.885 . . . . 0.0 115.132 174.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -65.65 -24.47 67.03 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 122.584 0.354 . . . . 0.0 111.455 -175.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 127' ' ' GLU . 72.8 t80 -53.02 -38.72 62.59 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.66 0.784 . . . . 0.0 111.304 176.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . 0.489 ' HE3' ' OE1' ' B' ' 83' ' ' GLU . 2.9 tmmm? -71.61 -49.99 35.09 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . 0.489 ' OE1' ' HE3' ' B' ' 82' ' ' LYS . 11.9 mm-40 -65.9 -26.85 67.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.521 0.201 . . . . 0.0 111.326 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.72 -56.07 26.46 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 172.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.483 ' O ' HG12 ' B' ' 89' ' ' ILE . 60.4 m95 -61.51 -42.55 98.98 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.186 176.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . 0.406 ' HG2' ' OE1' ' B' ' 83' ' ' GLU . 19.0 tptm -49.0 -55.18 12.72 Favored 'General case' 0 CA--C 1.501 -0.904 0 C-N-CA 125.424 1.49 . . . . 0.0 110.057 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -63.42 -46.43 86.39 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.305 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.16 -52.52 65.35 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 123.538 0.524 . . . . 0.0 112.387 -177.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 85' ' ' TRP . 29.3 pt -68.92 -29.18 42.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.129 0.49 . . . . 0.0 111.225 -177.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . 0.533 ' OE1' ' HA ' ' B' ' 96' ' ' PRO . 8.2 tt0 -78.25 -42.77 30.1 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.652 -179.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 12.0 tppt? -55.28 -37.65 67.58 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.063 1.345 . . . . 0.0 109.235 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.43 -31.49 72.66 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.54 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -86.55 -53.88 4.72 Favored 'General case' 0 N--CA 1.433 -1.308 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -161.04 179.75 8.18 Favored 'General case' 0 C--O 1.208 -1.094 0 C-N-CA 124.349 1.06 . . . . 0.0 108.484 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.624 ' SD ' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -64.62 122.01 76.26 Favored Pre-proline 0 C--N 1.291 -1.937 0 CA-C-O 121.242 0.544 . . . . 0.0 111.91 179.705 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.533 ' HA ' ' OE1' ' B' ' 90' ' ' GLN . 60.5 Cg_endo -93.45 -4.9 2.92 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 124.138 3.225 . . . . 0.0 113.315 -177.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . 0.502 ' HB2' ' HD3' ' B' ' 98' ' ' PRO . 5.8 m-20 -86.44 -48.57 0.52 Allowed Pre-proline 0 C--N 1.288 -2.099 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.774 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . 0.51 ' HB3' ' CE2' ' A' ' 19' ' ' PHE . 17.2 Cg_exo -77.77 52.37 3.95 Favored 'Trans proline' 0 C--N 1.371 1.715 0 C-N-CA 122.439 2.093 . . . . 0.0 110.18 169.047 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 68.1 t90 -87.67 -34.31 18.48 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.41 -2.451 0 N-CA-C 105.485 -2.042 . . . . 0.0 105.485 -176.487 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.497 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -129.4 -4.42 4.84 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.9 0.857 . . . . 0.0 108.838 171.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -113.63 123.56 50.23 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' A' ' 9' ' ' ILE . 11.4 tp -96.42 159.77 14.76 Favored 'General case' 0 C--N 1.291 -1.956 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.52 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.473 ' O ' HG13 ' A' ' 9' ' ' ILE . 34.5 p -86.76 143.52 27.48 Favored 'General case' 0 N--CA 1.42 -1.929 0 C-N-CA 123.214 0.606 . . . . 0.0 110.811 -177.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -52.19 -46.76 65.68 Favored 'General case' 0 C--O 1.244 0.786 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -174.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -60.32 -46.32 90.29 Favored 'General case' 0 CA--C 1.512 -0.488 0 O-C-N 123.269 0.356 . . . . 0.0 110.548 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 -66.13 -37.84 86.7 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.659 -178.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.492 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 30.5 mt -63.5 -43.01 98.17 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.0 177.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.79 -41.83 91.47 Favored 'General case' 0 C--O 1.259 1.584 0 CA-C-O 121.399 0.618 . . . . 0.0 110.935 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -60.68 -43.82 97.25 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.126 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.418 ' CZ ' ' HG3' ' A' ' 72' ' ' MET . 19.4 m-85 -62.92 -40.83 98.8 Favored 'General case' 0 C--O 1.168 -3.234 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.984 175.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.492 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -47.99 -52.54 19.41 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.388 0.613 . . . . 0.0 111.987 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -66.75 -48.14 70.02 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.0 -177.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.05 -31.53 69.19 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.434 0.635 . . . . 0.0 111.902 -177.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -65.41 -40.3 93.21 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 124.591 1.156 . . . . 0.0 109.702 177.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 26.1 m -69.87 -25.51 63.75 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.066 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -70.89 -43.19 68.86 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -66.04 -43.05 88.65 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.339 178.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -69.76 101.27 1.66 Allowed 'General case' 0 C--N 1.313 -1.017 0 O-C-N 123.947 0.779 . . . . 0.0 109.848 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -77.19 1.92 16.98 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -109.44 -13.78 14.53 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 175.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.39 24.54 73.67 Favored Glycine 0 N--CA 1.437 -1.234 0 CA-C-N 114.608 -1.178 . . . . 0.0 112.164 -176.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -98.95 -18.54 17.78 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 119.572 -0.851 . . . . 0.0 112.205 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.25 29.73 7.77 Favored Glycine 0 C--N 1.307 -1.033 0 C-N-CA 120.677 -0.773 . . . . 0.0 114.603 175.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.8 p -145.43 129.86 17.81 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 173.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 51.6 mt -101.7 115.45 43.51 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.987 -177.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.9 p -84.66 178.01 7.83 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.522 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.7 p -64.83 -29.25 70.2 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.475 0.655 . . . . 0.0 109.55 176.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -59.23 -57.85 11.2 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.772 177.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -64.48 -39.4 93.73 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 114.265 -1.334 . . . . 0.0 111.093 -177.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.5 mt -56.17 -57.5 11.91 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 123.373 0.421 . . . . 0.0 110.548 175.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.72 -31.31 79.66 Favored Glycine 0 C--O 1.211 -1.285 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.366 -178.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.9 m -69.13 -46.99 66.26 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 116.839 0.32 . . . . 0.0 110.825 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 28.4 m -70.69 -28.64 34.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 121.306 0.575 . . . . 0.0 110.755 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.517 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 22.2 mtt -68.81 -40.81 79.35 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 173.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -66.35 -30.57 71.0 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 123.851 0.86 . . . . 0.0 110.891 178.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.7 m -64.53 -25.95 68.21 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.462 0.649 . . . . 0.0 110.132 176.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -106.34 13.92 28.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.023 178.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.1 34.65 41.01 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 115.386 0.914 . . . . 0.0 115.386 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.431 ' C ' HD21 ' A' ' 42' ' ' ASN . 4.8 tt0 -131.22 129.84 42.15 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 118.295 1.047 . . . . 0.0 109.853 176.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.431 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.82 86.02 45.36 Favored Pre-proline 0 C--N 1.305 -1.347 0 O-C-N 122.126 -0.359 . . . . 0.0 110.489 176.75 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.517 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 16.6 Cg_exo -70.02 163.62 37.82 Favored 'Trans proline' 0 C--O 1.246 0.905 0 C-N-CA 122.992 2.461 . . . . 0.0 111.96 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.487 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 44.0 p -73.85 142.96 46.06 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 174.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -72.13 -19.08 61.84 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.034 -174.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.83 -39.72 92.8 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.095 174.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.487 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 37.8 mm-40 -65.14 -42.54 93.71 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 69.9 mt -65.89 -40.55 91.65 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.82 -1.082 . . . . 0.0 112.983 -175.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.29 -44.96 93.56 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.82 177.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -64.16 -38.04 89.61 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.984 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 38.4 tpp -60.11 -50.89 71.91 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.977 -1.011 . . . . 0.0 109.798 178.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.8 mt -60.79 -51.79 69.1 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.483 177.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -63.92 -13.4 45.29 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -173.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -72.28 -40.99 67.2 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.406 HG12 ' HB2' ' A' ' 71' ' ' MET . 22.0 m -97.24 -21.98 5.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.211 -176.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -72.36 112.08 8.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.299 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.51 -27.12 24.2 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-O 121.194 0.521 . . . . 0.0 110.914 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.33 -11.81 31.5 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -174.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.52 58.68 12.67 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.414 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -102.88 -16.83 15.77 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.2 23.35 34.91 Favored Glycine 0 N--CA 1.419 -2.451 0 N-CA-C 108.83 -1.708 . . . . 0.0 108.83 -173.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 49.4 p -140.35 137.13 33.84 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-N 115.567 -0.316 . . . . 0.0 111.039 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 57.5 mt -91.03 104.77 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.538 0 N-CA-C 104.269 -2.493 . . . . 0.0 104.269 173.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -84.0 168.17 16.2 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.544 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 57.8 t80 -52.87 -56.01 27.61 Favored Pre-proline 0 CA--C 1.554 1.128 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -175.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.75 -39.79 75.95 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 122.621 2.214 . . . . 0.0 112.547 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -70.38 -37.6 74.57 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.309 0.576 . . . . 0.0 110.056 -177.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -62.76 -41.97 99.47 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 72.2 mt -62.24 -49.28 76.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.014 178.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.1 m -56.87 -42.8 80.44 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.356 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.406 ' HB2' HG12 ' A' ' 55' ' ' VAL . 32.1 ttp -58.76 -46.68 86.9 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.165 0.586 . . . . 0.0 111.689 178.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.418 ' HG3' ' CZ ' ' A' ' 12' ' ' PHE . 23.2 mmt -71.76 -37.39 70.5 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.716 -177.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.31 -43.19 99.4 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -63.39 -28.94 70.33 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.69 176.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -69.01 -38.3 79.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.415 ' C ' ' H ' ' A' ' 78' ' ' ASP . 62.9 mtt -69.42 -47.96 62.5 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.51 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 87.3 tttt 68.44 -28.04 0.15 Allowed 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 174.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 76' ' ' MET . 33.1 m-20 82.09 12.69 0.59 Allowed 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 126.264 1.826 . . . . 0.0 109.219 -172.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.9 m -139.17 37.59 2.11 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -80.77 -36.22 32.15 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.202 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.7 m -69.47 125.51 26.93 Favored 'General case' 0 N--CA 1.427 -1.599 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.46 -172.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 70.76 -48.65 0.66 Allowed 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 125.564 1.546 . . . . 0.0 112.949 -177.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -66.33 -50.11 64.71 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 120.839 0.352 . . . . 0.0 111.668 -172.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -84.68 -26.0 28.04 Favored 'General case' 0 CA--C 1.494 -1.186 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.991 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 4.9 mm -72.79 -36.69 53.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.733 -175.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -73.13 -30.94 63.97 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 176.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -67.99 -46.18 72.01 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.93 -27.91 69.17 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.024 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -76.55 -46.3 26.96 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -57.48 -38.7 74.97 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.529 1.132 . . . . 0.0 111.43 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.59 ' O ' ' HE2' ' A' ' 94' ' ' LYS . 11.6 p -68.06 -19.85 25.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.754 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -96.19 -52.39 4.03 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.742 177.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -80.46 100.94 8.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.576 0.703 . . . . 0.0 111.073 -178.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.59 ' HE2' ' O ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -78.52 -24.04 45.97 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.487 -0.779 . . . . 0.0 113.081 -179.424 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.91 -13.89 52.37 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.556 -0.858 . . . . 0.0 110.523 -176.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.28 43.26 95.49 Favored Glycine 0 CA--C 1.499 -0.924 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 178.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -101.61 -19.27 15.52 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 120.951 0.405 . . . . 0.0 110.603 -174.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.96 11.52 60.1 Favored Glycine 0 C--N 1.314 -0.684 0 C-N-CA 119.517 -1.325 . . . . 0.0 111.366 -179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.475 ' HB3' HE21 ' A' ' 135' ' ' GLN . 51.9 m-85 -140.93 130.74 24.31 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.0 mt -103.59 133.74 46.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.8 t -100.95 158.94 15.62 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.88 -42.56 76.83 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 177.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.18 -33.52 75.65 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.772 177.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.504 ' O ' ' HB3' ' A' ' 107' ' ' HIS . 4.2 tp10 -65.52 -49.44 68.98 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 174.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.542 ' O ' ' HG2' ' A' ' 109' ' ' MET . 22.0 mt -56.52 -48.23 77.66 Favored 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.4 -176.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -56.1 -43.96 78.57 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.504 ' HB3' ' O ' ' A' ' 104' ' ' GLU . 6.8 t-80 -52.87 -55.71 21.15 Favored 'General case' 0 C--O 1.254 1.316 0 C-N-CA 123.996 0.918 . . . . 0.0 111.365 176.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.448 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.6 p -73.24 -33.51 41.64 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.641 0 C-N-CA 120.243 -0.583 . . . . 0.0 111.494 -176.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.542 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.2 mmt -64.87 -43.71 92.05 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 122.432 0.293 . . . . 0.0 111.279 -178.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.6 m -62.04 -35.5 78.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -73.04 -27.21 61.62 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.113 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 78.0 mt -89.14 -21.18 23.47 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.03 -0.419 . . . . 0.0 111.73 -177.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.51 20.27 13.81 Favored Glycine 0 C--N 1.312 -0.794 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.21 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.479 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 1.4 mp0 -100.32 110.68 22.91 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 123.476 0.71 . . . . 0.0 109.779 178.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -82.03 69.63 8.78 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 122.236 1.017 . . . . 0.0 111.591 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.606 HD12 ' SD ' ' A' ' 124' ' ' MET . 56.6 mt -101.85 139.32 37.65 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 177.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 40.2 p -84.58 171.33 12.55 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.38 -31.89 73.17 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -66.15 -51.21 60.05 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.813 177.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' A' ' 124' ' ' MET . 29.0 tt0 -66.56 -42.87 86.41 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.877 -176.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.512 ' HA ' ' SD ' ' A' ' 124' ' ' MET . 23.1 m -66.12 -31.36 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 120.429 -0.509 . . . . 0.0 111.169 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -68.06 -38.86 82.92 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.484 0.659 . . . . 0.0 109.702 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -66.38 -32.41 73.77 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.335 175.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.606 ' SD ' HD12 ' A' ' 116' ' ' LEU . 92.6 mtp -63.58 -45.01 92.38 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 174.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.3 mm -57.58 -50.25 77.89 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.144 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.246 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.2 ttp180 -59.28 -25.01 63.73 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 124' ' ' MET . 30.2 mm-40 -65.83 -48.88 70.16 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.974 0.416 . . . . 0.0 111.448 173.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -91.81 -23.45 19.7 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -173.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.499 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 30.2 t70 -72.8 96.28 2.04 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 176.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.0 mt -83.53 -53.08 12.1 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.559 -176.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -79.6 -9.66 59.66 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -173.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.499 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 81.37 55.91 3.12 Favored Glycine 0 C--N 1.307 -1.041 0 C-N-CA 120.746 -0.74 . . . . 0.0 113.482 173.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -104.37 -16.18 15.2 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 98.0 -5.01 61.25 Favored Glycine 0 CA--C 1.494 -1.247 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.475 HE21 ' HB3' ' A' ' 99' ' ' TYR . 28.9 mt-30 -143.59 127.08 16.88 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -76.05 128.43 37.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 123.795 0.684 . . . . 0.0 112.769 -176.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.2 m-80 -83.83 162.28 20.63 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.429 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -64.89 -39.06 92.94 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.73 -21.7 63.44 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.552 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -88.18 -39.92 14.12 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -62.88 -42.83 99.91 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.835 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 27.6 m -62.07 -30.83 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-O 121.077 0.465 . . . . 0.0 111.132 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -48.88 31.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 25.7 ttt -60.54 -42.18 95.99 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.996 0.427 . . . . 0.0 110.765 178.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 41.2 tpp -60.54 -27.26 67.52 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.742 0.817 . . . . 0.0 112.362 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 12.4 p -104.38 2.63 31.47 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.035 0.445 . . . . 0.0 111.404 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -92.55 91.28 7.51 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 121.262 0.553 . . . . 0.0 111.552 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 51.6 mtpt . . . . . 0 C--N 1.31 -1.134 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 176.005 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 45.9 t . . . . . 0 N--CA 1.438 -1.037 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -80.23 -13.47 12.47 Favored 'Trans proline' 0 N--CA 1.447 -1.234 0 C-N-CA 121.824 1.683 . . . . 0.0 111.122 175.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . 67.48 -52.76 0.49 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.824 1.65 . . . . 0.0 113.006 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -134.57 116.87 15.53 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 15.1 m -105.82 22.26 15.89 Favored 'General case' 0 C--N 1.291 -1.96 0 CA-C-O 120.999 0.428 . . . . 0.0 110.375 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -126.23 78.02 1.73 Allowed 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 112.179 0.436 . . . . 0.0 112.179 -172.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 33.8 m80 63.85 -34.9 0.15 Allowed 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 174.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -67.65 -57.33 6.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 118.866 0.757 . . . . 0.0 111.378 -176.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -67.76 -32.94 73.87 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.657 0.741 . . . . 0.0 109.165 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.28 -26.26 64.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.689 -176.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.13 95.5 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.558 ' O ' HG12 ' B' ' 89' ' ' ILE . 86.0 m95 -65.75 -48.56 71.44 Favored 'General case' 0 CA--C 1.496 -1.097 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.063 176.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -55.93 -45.14 78.85 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 124.003 0.814 . . . . 0.0 110.771 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 27.0 m80 -61.72 -56.93 14.38 Favored 'General case' 0 C--O 1.206 -1.204 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.033 176.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.43 -51.85 63.64 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.628 ' O ' ' HE3' ' B' ' 93' ' ' LYS . 37.8 pt -62.57 -43.3 98.32 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.164 -177.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -71.78 -42.98 66.48 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.0 -178.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . 0.481 ' CD ' ' HD3' ' B' ' 96' ' ' PRO . 21.4 tptm -56.37 -44.49 80.2 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 125.035 1.334 . . . . 0.0 111.587 178.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . 0.404 ' HB1' HG22 ' A' ' 91' ' ' VAL . . . -63.22 -32.93 74.46 Favored 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.637 -178.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.628 ' HE3' ' O ' ' B' ' 89' ' ' ILE . 8.5 mtmp? -99.67 -11.26 21.06 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -174.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -164.25 117.06 1.36 Allowed 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 -175.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -58.61 147.82 68.87 Favored Pre-proline 0 CA--C 1.492 -1.263 0 CA-C-O 117.853 -1.07 . . . . 0.0 108.717 -174.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.481 ' HD3' ' CD ' ' B' ' 91' ' ' LYS . 36.1 Cg_exo 2.92 73.68 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.111 1 C-N-CA 125.836 4.357 . . . . 0.0 114.347 -162.508 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . 0.413 ' OD1' ' HB2' ' B' ' 99' ' ' TRP . 15.2 t70 -53.14 110.38 1.97 Allowed Pre-proline 0 C--O 1.241 0.626 0 CA-C-N 113.003 -1.908 . . . . 0.0 111.16 -173.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -73.93 93.98 0.88 Allowed 'Trans proline' 0 N--CA 1.442 -1.531 0 C-N-CA 122.247 1.965 . . . . 0.0 109.599 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . 0.413 ' HB2' ' OD1' ' B' ' 97' ' ' ASP . 42.9 t90 -126.47 116.57 21.33 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -175.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.282 -2.343 0 O-C-N 124.15 0.906 . . . . 0.0 109.356 -176.891 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.674 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -133.08 -18.48 2.31 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 120.682 0.277 . . . . 0.0 110.649 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.0 mm-40 -80.23 131.54 35.71 Favored 'General case' 0 C--O 1.248 1.024 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.8 tp -132.39 165.97 23.04 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 -176.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.7 p -90.12 143.82 26.44 Favored 'General case' 0 C--N 1.303 -1.42 0 C-N-CA 122.877 0.471 . . . . 0.0 111.718 -178.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.423 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 2.4 mp0 -46.54 -55.12 8.06 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 125.606 1.562 . . . . 0.0 113.342 -175.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -61.39 -40.8 95.68 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.188 0.595 . . . . 0.0 111.074 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.441 ' O ' ' HD2' ' A' ' 12' ' ' PHE . 6.3 tp-100 -65.81 -41.65 91.61 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.482 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 69.4 mt -63.33 -35.61 72.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.556 177.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.92 -39.12 87.29 Favored 'General case' 0 C--O 1.257 1.449 0 CA-C-O 121.093 0.473 . . . . 0.0 110.576 177.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -60.22 -48.38 81.98 Favored 'General case' 0 C--O 1.247 0.945 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 175.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.441 ' HD2' ' O ' ' A' ' 8' ' ' GLN . 28.2 m-85 -56.6 -46.52 80.82 Favored 'General case' 0 C--O 1.184 -2.393 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.727 175.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 33.9 mmtp -46.82 -49.83 19.38 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.501 0.721 . . . . 0.0 112.073 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -65.51 -57.27 8.64 Favored 'General case' 0 C--O 1.255 1.379 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.074 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.51 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -68.15 -28.54 67.39 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.806 -175.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.8 -42.58 99.19 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 123.176 0.59 . . . . 0.0 109.78 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.4 m -72.59 -18.23 61.62 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.111 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.51 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 62.8 tp -68.9 -42.18 77.23 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.099 0.475 . . . . 0.0 110.198 172.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -78.95 -35.97 42.37 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.143 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -77.17 99.32 5.38 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.683 175.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -74.42 -3.08 28.4 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.331 -0.85 . . . . 0.0 113.277 -174.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.406 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 21.6 m-20 -110.95 -13.26 14.14 Favored 'General case' 0 CA--C 1.49 -1.363 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.729 -179.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.41 23.18 68.23 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 -176.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.406 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 3.9 p-10 -97.25 -16.36 20.39 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.891 0.377 . . . . 0.0 110.044 -173.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 101.98 8.35 45.17 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 114.851 0.701 . . . . 0.0 114.851 176.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.4 p -130.53 136.55 49.05 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 118.471 1.136 . . . . 0.0 109.628 177.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.1 mt -102.89 114.64 43.05 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 176.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.0 p -87.12 172.24 10.1 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.469 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.8 p -65.79 -32.83 74.58 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.128 0.489 . . . . 0.0 110.218 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -62.43 -45.95 90.76 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.589 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -66.6 -41.65 88.09 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.74 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.432 ' HB3' ' SD ' ' A' ' 36' ' ' MET . 89.7 mt -55.64 -62.1 1.91 Allowed 'General case' 0 CA--C 1.501 -0.929 0 O-C-N 124.006 0.816 . . . . 0.0 109.874 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.4 -29.12 65.75 Favored Glycine 0 C--O 1.2 -1.974 0 C-N-CA 121.18 -0.533 . . . . 0.0 113.422 -175.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.1 m -73.61 -46.2 48.4 Favored 'General case' 0 CA--C 1.554 1.128 0 CA-C-N 117.606 0.703 . . . . 0.0 111.354 178.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.97 -28.21 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 121.771 0.796 . . . . 0.0 109.97 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.674 ' SD ' ' HA ' ' B' ' 96' ' ' PRO . 48.3 mtp -77.68 -28.73 51.16 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.344 177.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -68.57 -29.08 67.55 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.0 m -65.2 -35.45 81.1 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.157 173.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -82.65 -22.44 34.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.142 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.74 25.02 5.59 Favored Glycine 0 N--CA 1.435 -1.414 0 C-N-CA 120.816 -0.706 . . . . 0.0 114.236 178.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -139.53 122.6 16.8 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 118.105 0.953 . . . . 0.0 109.476 176.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -141.11 89.85 9.52 Favored Pre-proline 0 C--N 1.298 -1.64 0 CA-C-O 121.71 0.766 . . . . 0.0 111.334 174.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -75.95 172.42 16.31 Favored 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.785 2.324 . . . . 0.0 112.126 178.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 p -73.07 164.33 26.85 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.941 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -52.76 -46.81 67.67 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.802 1.241 . . . . 0.0 111.095 -176.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.46 -43.4 83.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.289 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -64.19 -43.14 95.97 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.25 0.548 . . . . 0.0 110.546 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.2 mt -68.55 -47.08 67.77 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.76 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -58.67 -46.1 87.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.47 0.653 . . . . 0.0 109.531 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -62.57 -30.86 71.63 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.6 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 34.9 tpp -83.04 -39.51 21.14 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.9 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 42.4 mt -57.74 -42.98 83.0 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 176.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -56.05 -18.42 9.54 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 124.272 1.029 . . . . 0.0 113.546 -177.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -70.14 -43.76 70.25 Favored 'General case' 0 N--CA 1.393 -3.323 0 O-C-N 121.667 -0.646 . . . . 0.0 110.717 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.413 HG13 ' SD ' ' A' ' 71' ' ' MET . 12.2 m -95.29 -25.29 4.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.202 0.525 . . . . 0.0 110.095 -177.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -67.86 115.94 7.96 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.776 -176.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.12 -27.99 57.29 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.155 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -94.55 -12.45 27.55 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -174.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.03 37.56 63.36 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -173.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.5 p-10 -104.04 -7.58 20.19 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -171.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.78 23.18 11.08 Favored Glycine 0 C--N 1.307 -1.052 0 C-N-CA 120.195 -1.002 . . . . 0.0 113.818 172.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.55 132.66 21.61 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 116.819 0.31 . . . . 0.0 110.484 177.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 52.6 mt -92.39 110.05 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 176.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -85.34 178.43 7.47 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -63.07 -54.79 43.04 Favored Pre-proline 0 C--N 1.298 -1.649 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -174.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -52.11 -40.05 69.38 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.616 2.21 . . . . 0.0 112.654 175.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -66.12 -40.85 90.99 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.4 0.619 . . . . 0.0 109.795 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.49 ' CZ ' ' HB2' ' B' ' 100' ' ' ALA . 5.3 t80 -64.18 -40.88 97.05 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.94 177.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.1 mt -61.05 -48.45 81.68 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.56 176.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.6 m -56.92 -44.66 82.65 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 123.427 0.454 . . . . 0.0 110.257 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.413 ' SD ' HG13 ' A' ' 55' ' ' VAL . 30.5 ttp -56.99 -44.68 82.98 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.4 mmt -85.8 -32.54 21.73 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 119.086 -1.046 . . . . 0.0 112.52 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.26 -40.42 97.37 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -66.07 -26.21 67.39 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 121.848 0.832 . . . . 0.0 110.364 178.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -87.28 -28.99 21.97 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 114.626 -1.17 . . . . 0.0 109.389 -176.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.3 ttm -76.47 -67.06 0.73 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.53 -1.213 . . . . 0.0 111.479 -177.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -100.39 90.68 4.39 Favored 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -174.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 54.65 99.43 0.01 OUTLIER 'General case' 0 CA--C 1.49 -1.333 0 O-C-N 124.806 1.316 . . . . 0.0 114.092 175.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.7 t -83.01 61.54 6.06 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-O 122.427 1.108 . . . . 0.0 109.157 174.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -81.32 80.79 7.66 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 122.531 1.157 . . . . 0.0 108.147 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 50.3 m -175.53 -28.86 0.01 OUTLIER 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 104.421 -2.437 . . . . 0.0 104.421 -173.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.428 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 2.1 mp0 63.48 23.55 13.71 Favored 'General case' 0 C--N 1.36 1.042 0 CA-C-N 113.595 -1.639 . . . . 0.0 112.197 175.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 45.0 mt-10 -65.06 -59.56 4.0 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -52.93 -39.75 63.09 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.257 1.027 . . . . 0.0 109.496 176.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.4 mm -67.63 -51.26 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-N 113.376 -1.738 . . . . 0.0 110.354 -173.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.412 ' O ' ' HG2' ' A' ' 90' ' ' ARG . 42.8 ttm105 -71.92 -30.99 65.92 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.338 -178.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 47.6 mt-10 -61.28 -44.77 96.67 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.501 0.667 . . . . 0.0 110.181 174.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.46 -34.17 75.47 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.347 178.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -66.89 -50.32 62.84 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.946 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 86' ' ' ARG . 9.6 ptm180 -66.43 -19.72 65.87 Favored 'General case' 0 N--CA 1.419 -1.998 0 C-N-CA 123.454 0.702 . . . . 0.0 112.767 -176.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.4 p -83.15 -28.72 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 C-N-CA 118.724 -1.191 . . . . 0.0 111.006 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -83.52 -48.19 10.54 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 177.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -75.87 105.33 6.85 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 175.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.446 ' HZ2' ' HB3' ' A' ' 94' ' ' LYS . 7.9 mtpm? -77.88 -16.98 57.84 Favored 'General case' 0 C--N 1.288 -2.093 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -169.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -115.01 -13.06 11.91 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 120.262 -0.575 . . . . 0.0 111.939 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.83 55.75 5.22 Favored Glycine 0 N--CA 1.437 -1.262 0 N-CA-C 108.327 -1.909 . . . . 0.0 108.327 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -100.69 -18.47 16.51 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.065 0.46 . . . . 0.0 110.44 -174.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.64 11.99 59.99 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.256 -1.137 . . . . 0.0 110.256 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -147.46 130.59 16.4 Favored 'General case' 0 CA--C 1.498 -1.024 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -176.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.4 mt -104.74 132.63 50.99 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 175.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.3 p -109.82 160.09 16.65 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.481 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.84 -46.34 82.35 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -175.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.5 98.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.181 0.515 . . . . 0.0 109.87 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -61.62 -40.13 93.77 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.518 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 4.0 tt -61.56 -43.55 98.65 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.446 ' HG3' HG23 ' A' ' 121' ' ' VAL . 31.0 mtm180 -60.89 -40.49 93.22 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 121.249 -0.181 . . . . 0.0 111.473 174.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -57.24 -50.82 71.68 Favored 'General case' 0 C--O 1.244 0.802 0 O-C-N 123.174 0.297 . . . . 0.0 111.523 178.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.517 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.2 p -68.6 -34.42 65.1 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 C-N-CA 119.819 -0.753 . . . . 0.0 110.06 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 23.3 mmt -65.7 -36.28 83.17 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 58.3 m -63.08 -36.9 85.13 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -69.12 -35.01 75.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.267 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 80.0 mt -87.5 -20.49 26.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -172.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 71.07 32.21 66.05 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 116.335 -0.393 . . . . 0.0 112.279 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -81.14 -25.12 37.13 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -178.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt 69.55 71.92 0.24 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.887 0.875 . . . . 0.0 111.0 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 32.6 mt -118.61 130.58 55.96 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 37.8 p -83.47 174.09 10.92 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.909 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -57.12 -44.16 83.04 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 122.939 0.496 . . . . 0.0 111.013 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -55.57 -44.65 77.08 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 123.765 0.666 . . . . 0.0 111.251 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -69.52 -48.91 58.96 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.824 -175.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.446 HG23 ' HG3' ' A' ' 106' ' ' ARG . 7.3 m -67.88 -34.23 66.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.314 -177.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -69.87 -40.13 75.92 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.229 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.489 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 11.1 tp10 -65.62 -42.14 91.91 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 54.1 mtt -57.3 -50.91 71.43 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.65 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 121' ' ' VAL . 42.8 mm -56.01 -47.16 80.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -63.05 -29.97 71.23 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 123' ' ' GLU . 49.1 mt-10 -70.49 -42.42 71.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.016 0.436 . . . . 0.0 110.296 177.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.41 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -81.55 -33.38 31.74 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.22 -0.446 . . . . 0.0 112.01 -176.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -68.37 107.3 2.8 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 123.894 0.878 . . . . 0.0 109.975 177.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 68.9 mt -82.54 -42.41 18.38 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.752 -177.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -76.02 -11.79 60.01 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.007 0.432 . . . . 0.0 112.046 -174.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 68.84 46.98 58.15 Favored Glycine 0 N--CA 1.44 -1.063 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -99.61 -16.18 18.32 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 121.412 0.625 . . . . 0.0 110.51 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.22 -4.2 58.54 Favored Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.989 -0.624 . . . . 0.0 111.742 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -135.76 142.44 44.96 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -100.28 126.57 53.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 O-C-N 123.595 0.559 . . . . 0.0 111.086 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -85.22 169.02 14.22 Favored 'General case' 0 CA--C 1.501 -0.908 0 O-C-N 123.679 0.612 . . . . 0.0 110.57 177.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.531 ' O ' HG13 ' A' ' 142' ' ' VAL . 92.0 t80 -60.14 -45.46 92.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.302 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.419 ' O ' HG23 ' A' ' 142' ' ' VAL . 4.1 mp0 -62.46 -29.95 70.9 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.695 0.798 . . . . 0.0 111.276 -179.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.41 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 47.4 mt-10 -82.57 -35.71 26.89 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.198 0.523 . . . . 0.0 109.736 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -69.4 -39.36 77.99 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.341 178.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.531 HG13 ' O ' ' A' ' 138' ' ' TYR . 19.5 m -58.58 -34.79 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-O 120.701 0.286 . . . . 0.0 110.524 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.92 -40.86 90.3 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.364 -179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 70.2 mtp -86.38 -36.08 19.41 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 17.2 tpt -60.37 -40.28 90.26 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.625 -177.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' THR . . . . . 0.495 HG23 ' O ' ' A' ' 142' ' ' VAL . 14.5 t -94.72 11.99 29.38 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.753 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -96.53 173.91 7.11 Favored 'General case' 0 C--O 1.244 0.776 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 23.8 pttm . . . . . 0 C--N 1.303 -1.44 0 CA-C-O 119.192 -0.433 . . . . 0.0 109.919 178.837 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 45.8 t . . . . . 0 C--O 1.243 0.721 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -55.47 -52.14 8.34 Favored 'Trans proline' 0 C--N 1.359 1.101 0 C-N-CA 123.226 2.617 . . . . 0.0 111.344 176.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.26 133.04 34.15 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -60.5 -36.89 79.42 Favored 'General case' 0 C--N 1.31 -1.127 0 O-C-N 123.473 0.483 . . . . 0.0 112.232 -175.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 15.0 m -89.19 -17.84 28.32 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.113 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 53.3 t80 61.21 99.19 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.191 0.996 . . . . 0.0 108.847 -172.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 15.9 t60 171.82 -38.16 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -172.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -82.99 -48.3 10.8 Favored 'General case' 0 C--O 1.206 -1.187 0 N-CA-C 115.582 1.697 . . . . 0.0 115.582 -171.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -59.8 -38.34 81.64 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-O 122.36 1.076 . . . . 0.0 109.14 178.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' B' ' 83' ' ' GLU . 11.8 mp0 -63.22 -49.01 75.86 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 113.209 -1.814 . . . . 0.0 108.787 178.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.27 -32.53 72.76 Favored 'General case' 0 C--O 1.192 -1.971 0 CA-C-N 115.187 -0.915 . . . . 0.0 112.09 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -64.01 -43.39 95.79 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-N 118.228 0.467 . . . . 0.0 111.74 177.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -62.82 -46.26 88.8 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -60.32 -44.51 95.4 Favored 'General case' 0 C--O 1.205 -1.245 0 CA-C-N 114.078 -1.419 . . . . 0.0 111.873 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.7 -54.41 47.43 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 123.579 0.752 . . . . 0.0 112.149 -178.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 35.3 pt -64.82 -32.21 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 121.289 0.566 . . . . 0.0 111.274 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -69.09 -51.58 37.16 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.336 177.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -67.48 -45.19 76.6 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 123.443 0.697 . . . . 0.0 111.77 -178.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.59 -51.35 70.21 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.089 -176.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.574 ' HE2' ' SD ' ' B' ' 95' ' ' MET . 51.3 mtpt -78.47 -8.86 58.98 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.065 178.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 59.98 45.48 12.11 Favored 'General case' 0 CA--C 1.496 -1.13 0 CA-C-O 122.194 0.997 . . . . 0.0 108.497 -175.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.574 ' SD ' ' HE2' ' B' ' 93' ' ' LYS . 95.7 mmm -65.89 124.6 88.07 Favored Pre-proline 0 N--CA 1.422 -1.853 0 CA-C-N 113.359 -1.746 . . . . 0.0 110.704 -177.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.674 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 36.5 Cg_exo -64.03 -38.06 39.51 Favored 'Trans proline' 0 N--CA 1.433 -2.052 0 N-CA-C 107.107 -1.92 . . . . 0.0 107.107 168.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 7.0 t70 40.65 64.08 5.11 Favored Pre-proline 0 C--O 1.209 -1.034 0 CA-C-N 112.77 -2.014 . . . . 0.0 109.521 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.61 106.06 0.23 Allowed 'Trans proline' 0 C--N 1.361 1.185 0 C-N-CA 122.149 1.899 . . . . 0.0 111.986 -173.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 8.2 m-90 -76.68 44.07 0.35 Allowed 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 124.209 1.004 . . . . 0.0 109.997 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . 0.49 ' HB2' ' CZ ' ' A' ' 68' ' ' PHE . . . . . . . . 0 N--CA 1.393 -3.287 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.364 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -95.81 -62.79 1.23 Allowed 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.544 HE21 ' HA ' ' A' ' 3' ' ' GLN . 0.0 OUTLIER 64.73 70.99 0.47 Allowed 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.771 1.229 . . . . 0.0 109.839 -174.167 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.427 HD21 HG12 ' A' ' 9' ' ' ILE . 12.3 tp -126.01 150.84 47.79 Favored 'General case' 0 N--CA 1.422 -1.826 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.1 p -78.2 143.52 37.09 Favored 'General case' 0 N--CA 1.421 -1.896 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.099 179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -55.73 -45.16 78.03 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.348 1.059 . . . . 0.0 112.512 -175.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.5 -41.18 96.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.023 0.44 . . . . 0.0 109.985 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -63.85 -42.51 97.56 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.846 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.432 HG22 ' HE3' ' A' ' 13' ' ' LYS . 65.4 mt -63.55 -37.38 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.991 176.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.68 -41.73 99.25 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.436 177.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -61.58 -44.19 97.48 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.608 175.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -59.53 -48.69 80.69 Favored 'General case' 0 C--O 1.197 -1.658 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.402 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.432 ' HE3' HG22 ' A' ' 9' ' ' ILE . 98.3 mttt -50.09 -43.87 51.72 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 122.966 0.506 . . . . 0.0 111.99 179.661 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.86 -59.44 3.29 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.405 -177.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.83 -33.6 75.09 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -175.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -63.51 -45.2 91.76 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 123.029 0.532 . . . . 0.0 110.029 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.8 m -74.11 -16.43 61.01 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.276 0.56 . . . . 0.0 110.966 178.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -79.13 -54.18 6.25 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.311 176.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -80.48 -20.73 43.04 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -174.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -67.81 101.08 1.01 Allowed 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 171.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 74.5 mmtt -62.3 -7.7 4.71 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 116.083 1.883 . . . . 0.0 116.083 -171.065 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -109.95 -13.82 14.36 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.04 29.78 75.66 Favored Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.105 -176.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -104.34 -17.76 14.69 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.021 -0.671 . . . . 0.0 110.719 -176.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.95 4.16 63.45 Favored Glycine 0 N--CA 1.431 -1.693 0 C-N-CA 119.661 -1.257 . . . . 0.0 115.123 176.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.0 p -124.73 129.76 51.1 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 119.239 1.52 . . . . 0.0 109.582 170.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.9 mt -91.07 126.99 43.75 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.752 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.389 -174.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 p -102.57 167.01 10.2 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.15 173.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.8 p -53.73 -45.54 70.54 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 123.886 0.874 . . . . 0.0 113.005 -178.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -59.61 -34.98 73.45 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.495 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -70.35 -38.48 74.82 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.043 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.97 -47.87 84.46 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 175.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.418 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -64.28 -26.48 70.59 Favored Glycine 0 C--O 1.198 -2.151 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.473 179.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.7 m -68.99 -49.8 54.61 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 117.582 0.691 . . . . 0.0 110.565 179.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 30.4 m -70.62 -29.68 39.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.409 -0.516 . . . . 0.0 111.135 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.406 ' HG2' ' SD ' ' B' ' 95' ' ' MET . 66.9 mtt -69.13 -42.86 75.46 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 174.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 40.5 ttm180 -56.3 -39.57 72.95 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.344 1.458 . . . . 0.0 109.461 178.011 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 m -65.58 -32.64 74.33 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.141 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.448 HD11 ' SD ' ' B' ' 95' ' ' MET . 82.6 mt -87.97 -13.73 40.99 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.226 0.536 . . . . 0.0 110.275 178.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.74 47.11 2.36 Favored Glycine 0 N--CA 1.44 -1.064 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.783 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -148.5 130.29 15.13 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 176.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -132.54 82.4 57.03 Favored Pre-proline 0 C--N 1.286 -2.175 0 C-N-CA 120.258 -0.577 . . . . 0.0 112.046 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -70.36 160.87 48.06 Favored 'Trans proline' 0 C--O 1.243 0.771 0 C-N-CA 122.581 2.187 . . . . 0.0 109.657 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.5 t -80.81 157.38 25.75 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.725 -176.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.82 -31.11 62.39 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.078 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.09 -42.66 95.13 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.726 0.298 . . . . 0.0 111.029 176.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 51' ' ' MET . 40.7 mt-10 -66.79 -43.25 84.44 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.459 0.647 . . . . 0.0 109.295 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 66.1 mt -64.31 -38.27 90.46 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.71 -178.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -66.33 -39.07 89.0 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.567 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.41 -38.99 88.69 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.677 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.402 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 24.4 mmt -60.83 -40.38 92.55 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.228 176.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.7 mt -66.19 -47.04 85.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.953 177.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -64.62 -12.61 47.45 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.797 -173.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -61.84 -40.17 94.36 Favored 'General case' 0 N--CA 1.392 -3.367 0 C-N-CA 123.861 0.864 . . . . 0.0 110.428 175.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.501 HG11 ' HB2' ' A' ' 71' ' ' MET . 19.3 m -112.21 -10.94 11.94 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.813 -178.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -73.53 103.23 4.08 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.371 0.605 . . . . 0.0 110.859 -178.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.49 -11.12 49.89 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.023 -0.989 . . . . 0.0 111.693 -177.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -93.32 -11.49 32.29 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 119.869 -0.732 . . . . 0.0 110.566 -176.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 61.44 36.38 92.45 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -115.65 -12.14 11.6 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 122.732 -0.275 . . . . 0.0 110.967 -177.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.11 17.19 32.86 Favored Glycine 0 N--CA 1.434 -1.492 0 N-CA-C 115.373 0.909 . . . . 0.0 115.373 173.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.1 p -132.48 143.14 49.56 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-N 118.39 1.095 . . . . 0.0 111.49 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.9 mt -92.36 112.96 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -84.41 161.29 20.39 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 177.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.44 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 74.7 t80 -55.56 -50.04 89.22 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.685 0.394 . . . . 0.0 111.567 177.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.44 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 4.8 Cg_endo -49.68 -43.85 38.24 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 122.494 2.129 . . . . 0.0 112.671 173.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -71.78 -36.78 70.44 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.475 0.655 . . . . 0.0 110.045 -178.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -61.87 -43.82 98.06 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.751 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.1 mt -61.16 -45.45 94.6 Favored 'General case' 0 C--O 1.208 -1.131 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.269 178.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.5 m -57.12 -40.6 77.4 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 123.601 0.563 . . . . 0.0 110.536 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.501 ' HB2' HG11 ' A' ' 55' ' ' VAL . 27.5 ttp -55.51 -55.84 27.25 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.066 0.947 . . . . 0.0 112.143 -179.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.413 ' SD ' ' HE1' ' A' ' 71' ' ' MET . 1.1 mpt? -79.5 -38.55 34.13 Favored 'General case' 0 C--O 1.196 -1.711 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -179.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.26 -33.87 74.23 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -176.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -83.54 -19.17 36.15 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.896 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.432 ' HZ2' ' CG ' ' B' ' 97' ' ' ASP . 80.7 tttt -83.07 -48.08 10.98 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.46 ' HA ' ' OG1' ' A' ' 79' ' ' THR 0.262 1.8 ppp? -103.91 104.77 14.8 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 122.397 1.094 . . . . 0.0 113.388 -179.668 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 52.6 mttp -119.18 -66.83 1.03 Allowed 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 175.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -140.79 30.51 1.86 Allowed 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 124.137 1.922 . . . . 0.0 105.869 178.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.46 ' OG1' ' HA ' ' A' ' 76' ' ' MET . 61.1 m -64.71 -5.25 5.38 Favored 'General case' 0 C--N 1.283 -2.292 0 C-N-CA 129.454 3.102 . . . . 0.0 113.111 -174.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.94 -27.65 66.79 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 125.086 1.354 . . . . 0.0 109.901 -178.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.3 m -74.2 -51.42 15.51 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.506 -172.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -149.76 -38.81 0.15 Allowed 'General case' 0 C--O 1.205 -1.273 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.547 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 8.5 mm-40 -41.76 -59.6 1.62 Allowed 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 116.115 1.894 . . . . 0.0 116.115 -168.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -85.38 -24.78 27.41 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.908 0.861 . . . . 0.0 109.619 -175.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.409 HG21 ' HG2' ' A' ' 145' ' ' MET . 6.6 mm -73.46 -40.92 56.48 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.025 0 CA-C-N 114.436 -1.256 . . . . 0.0 108.762 -172.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -73.75 -26.67 60.78 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.855 178.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.547 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 43.1 mt-10 -64.02 -44.16 93.43 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 173.308 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.466 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -66.88 -37.01 83.6 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 114.552 -1.204 . . . . 0.0 110.803 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -72.18 -46.24 57.12 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.634 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.2 mtm180 -69.8 -18.28 63.46 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -177.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.466 HG12 ' O ' ' A' ' 88' ' ' ALA . 9.0 p -75.92 -20.57 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.037 178.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -97.0 -55.12 2.96 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -84.44 79.07 9.69 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.897 1.332 . . . . 0.0 109.367 176.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.452 ' HB2' ' HZ2' ' A' ' 94' ' ' LYS . 8.5 mtmp? -78.59 -18.36 54.71 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 113.289 -1.778 . . . . 0.0 111.482 -176.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -91.33 -12.49 34.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.889 -177.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.83 45.79 49.74 Favored Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -94.86 -14.65 24.37 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.414 0.626 . . . . 0.0 109.967 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.18 8.09 82.22 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.552 177.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -142.95 138.95 30.48 Favored 'General case' 0 CA--C 1.491 -1.327 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -178.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.452 ' HB ' HG11 ' A' ' 136' ' ' VAL . 3.1 mt -97.56 124.98 50.8 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 174.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.6 m -102.02 150.53 23.13 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 123.831 0.707 . . . . 0.0 110.221 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.44 -45.06 81.1 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.74 -41.08 85.64 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 122.63 0.372 . . . . 0.0 110.752 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -59.15 -55.85 29.75 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.137 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.574 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.6 tt -59.93 -40.55 89.3 Favored 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.294 -172.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.404 ' HB2' HG21 ' A' ' 121' ' ' VAL . 0.0 OUTLIER -65.29 -38.87 91.57 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -63.07 -51.02 68.29 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.285 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.54 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -65.87 -31.51 54.06 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.38 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.371 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.574 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.4 mmt -62.55 -37.1 84.82 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 13.8 m -60.68 -46.55 89.92 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 175.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -69.08 -16.73 63.75 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 114.622 -1.172 . . . . 0.0 111.814 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 95.3 mt -100.9 -2.36 32.19 Favored 'General case' 0 C--N 1.316 -0.889 0 O-C-N 121.985 -0.447 . . . . 0.0 111.617 -177.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 81.02 1.24 89.84 Favored Glycine 0 C--O 1.237 0.301 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.466 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.429 ' HG3' ' SD ' ' A' ' 109' ' ' MET . 20.4 mm-40 -70.9 -48.69 52.32 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 52.08 73.47 0.32 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 124.519 1.137 . . . . 0.0 110.665 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.1 mt -97.5 157.64 15.9 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.166 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.4 p -76.82 158.64 30.7 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.497 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -67.84 -23.09 65.12 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-O 121.112 0.482 . . . . 0.0 109.892 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.81 -42.83 63.44 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 123.158 0.583 . . . . 0.0 110.375 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -68.22 -44.5 75.6 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.335 0.588 . . . . 0.0 109.863 -176.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.404 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.4 m -69.07 -29.58 43.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.143 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.84 -41.15 92.11 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.8 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -63.85 -43.51 95.94 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.42 ' HA ' ' CE2' ' B' ' 81' ' ' PHE . 55.4 mtt -53.89 -34.8 60.53 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.413 178.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.413 ' CG2' ' HA ' ' A' ' 135' ' ' GLN . 51.3 mm -86.23 -58.52 3.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.46 179.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.62 -38.35 86.75 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -171.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -70.15 -28.65 65.52 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.426 ' HA ' ' SD ' ' A' ' 144' ' ' MET . . . -80.18 -35.76 35.97 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.221 179.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.67 85.56 0.65 Allowed 'General case' 0 C--N 1.307 -1.276 0 CA-C-O 122.582 1.182 . . . . 0.0 112.424 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 28.9 mt -83.44 -8.74 11.41 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 CA-C-N 114.078 -1.419 . . . . 0.0 109.106 174.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.414 ' HB2' ' OE2' ' A' ' 140' ' ' GLU . 31.8 t70 -90.15 -12.47 38.11 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.607 -172.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.79 35.68 58.41 Favored Glycine 0 N--CA 1.433 -1.551 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.611 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -100.35 -16.87 17.5 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.444 0.64 . . . . 0.0 109.772 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.95 -2.28 85.53 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -176.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.413 ' HA ' ' CG2' ' A' ' 125' ' ' ILE . 21.9 mt-30 -138.37 147.29 43.27 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.634 1.173 . . . . 0.0 108.803 -178.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.452 HG11 ' HB ' ' A' ' 100' ' ' ILE . 1.4 p -86.69 121.11 37.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 C-N-CA 119.811 -0.756 . . . . 0.0 110.879 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -91.54 177.07 6.32 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.987 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -70.05 -41.6 73.98 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.984 -173.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -63.94 -42.13 97.43 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.095 0.474 . . . . 0.0 111.408 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.414 ' OE2' ' HB2' ' A' ' 131' ' ' ASP . 0.5 OUTLIER -70.48 -30.66 67.51 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.835 177.347 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -70.75 -45.37 64.94 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.054 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.9 m -62.45 -33.91 61.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-O 120.927 0.394 . . . . 0.0 110.828 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -60.9 -46.41 90.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.966 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.426 ' SD ' ' HA ' ' A' ' 128' ' ' ALA . 40.1 mtm -75.23 -40.17 59.29 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.693 -178.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.409 ' HG2' HG21 ' A' ' 85' ' ' ILE . 10.0 tpt -61.22 -32.29 72.06 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.508 -175.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 22.9 p -89.52 -10.86 44.63 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-O 121.284 0.564 . . . . 0.0 111.703 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -108.95 27.46 9.47 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 122.77 1.271 . . . . 0.0 108.172 178.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.579 ' NZ ' ' HB3' ' A' ' 148' ' ' LYS . 0.8 OUTLIER . . . . . 0 C--N 1.281 -2.41 0 CA-C-N 113.759 -1.564 . . . . 0.0 108.632 -176.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 22.4 m . . . . . 0 N--CA 1.437 -1.087 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -63.14 145.74 93.83 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 121.995 1.797 . . . . 0.0 110.234 177.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -54.18 -48.26 71.14 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.311 0.645 . . . . 0.0 112.114 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -65.53 -42.58 91.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.382 -179.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 13.5 m -68.02 -36.23 79.6 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.011 0.434 . . . . 0.0 110.584 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -66.66 -49.51 65.94 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 178.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 25.4 t-80 -60.3 -38.54 83.97 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . 0.42 ' CE2' ' HA ' ' A' ' 124' ' ' MET . 12.6 t80 -56.05 -52.47 64.14 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 124.314 1.046 . . . . 0.0 111.451 175.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -69.35 -25.77 64.35 Favored 'General case' 0 C--O 1.247 0.947 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -177.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -80.26 -44.06 20.29 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.099 0.476 . . . . 0.0 110.147 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.84 -37.16 83.43 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.055 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.452 ' O ' HG13 ' B' ' 89' ' ' ILE . 48.2 m95 -57.56 -45.66 84.87 Favored 'General case' 0 C--O 1.206 -1.235 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 176.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -55.56 -49.51 72.48 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 122.512 1.149 . . . . 0.0 109.811 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -66.41 -36.6 83.25 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 113.149 -1.841 . . . . 0.0 111.195 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -77.44 -41.28 40.36 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.452 HG13 ' O ' ' B' ' 85' ' ' TRP . 83.1 mt -57.85 -50.99 75.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 122.943 0.497 . . . . 0.0 111.886 -178.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -68.18 -31.39 70.9 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.615 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -65.99 -46.29 78.53 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.839 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.69 92.63 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.265 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -68.75 -13.6 62.49 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.299 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 58.4 m80 72.11 19.68 4.49 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.236 1.014 . . . . 0.0 110.199 -177.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.448 ' SD ' HD11 ' A' ' 39' ' ' LEU . 75.3 mtp 51.14 78.82 0.38 Allowed Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 114.538 1.31 . . . . 0.0 114.538 -177.063 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -88.88 6.7 4.56 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.455 2.104 . . . . 0.0 109.441 175.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . 0.432 ' CG ' ' HZ2' ' A' ' 75' ' ' LYS . 10.7 m-20 -132.05 117.91 16.14 Favored Pre-proline 0 N--CA 1.429 -1.502 0 CA-C-N 114.201 -1.363 . . . . 0.0 108.91 -176.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -75.05 95.74 0.99 Allowed 'Trans proline' 0 N--CA 1.44 -1.623 0 N-CA-C 107.078 -1.932 . . . . 0.0 107.078 168.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 33.0 p-90 -78.62 119.62 22.14 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 -172.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.414 -2.263 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 175.504 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.441 ' H1 ' ' CG ' ' A' ' 78' ' ' ASP . . . . . . . . 0 C--O 1.234 0.257 0 CA-C-O 121.406 0.622 . . . . 0.0 110.205 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -86.23 91.95 8.62 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.48 1.133 . . . . 0.0 113.689 -177.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -103.26 113.74 27.47 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 173.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.3 tp -132.38 145.45 51.24 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 -177.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.0 p -82.32 145.36 29.99 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -176.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -51.08 -50.59 58.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.812 1.245 . . . . 0.0 113.371 -176.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -66.72 -34.96 79.01 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.257 0.551 . . . . 0.0 110.705 -177.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.589 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 52.0 tp60 -74.36 -36.33 63.59 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.307 -178.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.55 -40.67 85.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.939 176.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.93 -38.81 92.5 Favored 'General case' 0 C--O 1.255 1.376 0 CA-C-O 121.334 0.588 . . . . 0.0 110.647 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.423 ' CD ' ' HZ2' ' B' ' 86' ' ' LYS . 35.7 tt0 -62.88 -45.51 92.19 Favored 'General case' 0 C--O 1.249 1.059 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.255 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.589 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 23.1 m-85 -60.45 -38.75 85.17 Favored 'General case' 0 C--O 1.197 -1.667 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.837 178.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.437 ' HG2' ' CZ ' ' A' ' 65' ' ' PHE . 98.9 mttt -55.17 -51.12 67.51 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 121.026 0.441 . . . . 0.0 111.304 177.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -68.04 -46.85 69.99 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.291 -178.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.598 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -70.52 -21.87 62.69 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.995 -176.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -67.51 -53.56 27.54 Favored 'General case' 0 CA--C 1.486 -1.513 0 C-N-CA 123.41 0.684 . . . . 0.0 109.408 174.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 t -67.4 -16.82 64.45 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 121.018 0.437 . . . . 0.0 110.359 -177.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.598 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 16.7 tp -59.35 -46.84 87.52 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.56 172.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.424 ' HB2' HG13 ' A' ' 35' ' ' VAL . 25.2 p90 -101.42 -25.79 13.81 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.985 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -75.98 99.15 4.47 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 174.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -48.96 -34.52 13.11 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 116.767 2.136 . . . . 0.0 116.767 -170.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.1 p30 -110.47 -13.11 14.31 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 27.58 73.66 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.813 -0.232 . . . . 0.0 112.851 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -81.65 -16.48 51.26 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.165 0.507 . . . . 0.0 110.952 -176.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.43 0.26 46.83 Favored Glycine 0 N--CA 1.434 -1.442 0 C-N-CA 120.657 -0.783 . . . . 0.0 114.252 -178.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.2 p -128.89 129.4 45.48 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 118.898 1.349 . . . . 0.0 109.955 173.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.6 mt -89.38 111.97 23.68 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 179.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.6 p -87.74 170.04 11.58 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.993 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.3 p -63.02 -33.57 75.71 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 123.019 0.2 . . . . 0.0 110.852 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -52.61 -54.82 27.92 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.253 174.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.75 -45.04 79.86 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.188 -174.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 71.5 mt -60.17 -45.68 92.28 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 178.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.98 -29.04 67.52 Favored Glycine 0 C--O 1.207 -1.532 0 C-N-CA 118.997 -1.573 . . . . 0.0 112.188 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.8 m -69.57 -44.12 71.47 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 117.255 0.528 . . . . 0.0 110.436 177.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.524 ' O ' ' HG3' ' B' ' 95' ' ' MET . 25.1 m -66.76 -36.21 76.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-O 121.149 0.499 . . . . 0.0 109.949 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.516 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 63.2 mtt -68.46 -42.51 78.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.607 176.063 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.407 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 68.5 ttt180 -62.85 -25.59 68.35 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 123.873 0.869 . . . . 0.0 110.819 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.0 m -63.09 -30.25 71.45 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.349 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -98.05 9.34 43.07 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 120.9 0.381 . . . . 0.0 111.077 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.42 -9.7 75.54 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.767 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.407 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 62.1 tt0 -71.8 118.36 14.55 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -113.41 84.43 7.7 Favored Pre-proline 0 C--N 1.289 -2.052 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 177.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.516 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 73.1 Cg_endo -89.65 162.33 5.25 Favored 'Trans proline' 0 N--CA 1.434 -2.015 0 C-N-CA 122.409 2.072 . . . . 0.0 111.237 177.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.2 p -89.13 167.53 13.05 Favored 'General case' 0 C--N 1.283 -2.297 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 175.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -64.84 -30.21 71.2 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.54 89.35 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.708 0.289 . . . . 0.0 110.834 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -66.8 -38.47 86.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.535 0.683 . . . . 0.0 110.584 179.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.1 mt -68.67 -44.8 73.27 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.149 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -63.49 -34.88 78.75 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.718 -1.128 . . . . 0.0 109.847 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.22 -43.19 98.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.707 177.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 14.6 tpt -69.06 -36.31 77.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.373 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 67.8 mt -63.31 -55.76 21.22 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.367 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.43 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -57.9 -31.8 67.12 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 123.411 0.684 . . . . 0.0 112.007 -175.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.47 -31.88 66.39 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 123.955 0.902 . . . . 0.0 110.048 178.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.639 HG13 ' SD ' ' A' ' 71' ' ' MET . 32.9 m -114.89 -11.4 12.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 O-C-N 121.825 -0.547 . . . . 0.0 112.12 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -76.26 114.55 15.06 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 -174.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.85 -10.39 53.54 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.191 -178.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -106.99 -12.37 15.45 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.717 -176.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.78 44.8 94.05 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -175.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -115.37 0.83 13.56 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -174.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.02 23.6 37.67 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.191 -1.004 . . . . 0.0 113.86 173.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.7 p -150.73 142.05 23.3 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 116.981 0.391 . . . . 0.0 111.364 179.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.3 mt -97.97 104.19 15.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 175.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.537 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 6.7 t70 -78.84 164.81 24.18 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 -178.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.437 ' CZ ' ' HG2' ' A' ' 13' ' ' LYS . 61.3 t80 -52.68 -50.39 81.06 Favored Pre-proline 0 CA--C 1.554 1.112 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.537 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 4.8 Cg_endo -49.81 -49.6 15.51 Favored 'Trans proline' 0 C--N 1.364 1.375 0 C-N-CA 122.735 2.29 . . . . 0.0 112.019 172.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -63.05 -37.98 89.37 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.268 0.556 . . . . 0.0 109.753 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.406 ' O ' ' HG2' ' A' ' 72' ' ' MET . 39.7 t80 -64.33 -39.34 93.7 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.417 178.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.9 mt -66.55 -42.49 87.05 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.6 m -57.53 -45.29 85.2 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.639 ' SD ' HG13 ' A' ' 55' ' ' VAL . 42.6 ttp -64.94 -37.96 89.38 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.493 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.464 ' HA ' ' HE1' ' A' ' 72' ' ' MET . 28.7 mmt -63.91 -43.3 96.36 Favored 'General case' 0 C--N 1.321 -0.674 0 O-C-N 122.259 -0.276 . . . . 0.0 110.863 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.97 -35.05 79.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.063 0.459 . . . . 0.0 109.895 176.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -69.88 -23.73 63.3 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.327 1.051 . . . . 0.0 110.749 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.476 ' HD3' ' O ' ' A' ' 71' ' ' MET . 4.1 mptp? -81.03 -20.41 41.76 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 121.888 -0.508 . . . . 0.0 111.377 177.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.401 ' HG3' ' HG3' ' A' ' 77' ' ' LYS . 21.5 ptp -123.36 -32.03 3.46 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -171.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.401 ' HG3' ' HG3' ' A' ' 76' ' ' MET . 50.4 mttm -128.72 -62.39 1.02 Allowed 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.112 0.482 . . . . 0.0 111.635 -172.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.441 ' CG ' ' H1 ' ' A' ' 1' ' ' ALA . 11.3 t70 -89.25 45.78 1.32 Allowed 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 122.873 1.321 . . . . 0.0 108.268 -175.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.7 m -71.65 109.75 5.77 Favored 'General case' 0 N--CA 1.406 -2.651 0 CA-C-N 114.015 -1.448 . . . . 0.0 109.096 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -69.11 -50.11 51.06 Favored 'General case' 0 CA--C 1.501 -0.931 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.971 -177.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.461 ' C ' ' H ' ' A' ' 83' ' ' GLU . 18.9 m -119.19 146.43 45.18 Favored 'General case' 0 N--CA 1.421 -1.91 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -74.64 17.79 0.19 Allowed 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.68 0.392 . . . . 0.0 111.613 -175.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.461 ' H ' ' C ' ' A' ' 81' ' ' SER . 9.2 tp10 -58.29 -50.27 74.21 Favored 'General case' 0 C--O 1.205 -1.272 0 C-N-CA 123.4 0.68 . . . . 0.0 109.448 -178.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -64.96 -29.29 70.21 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -178.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 30.0 mm -71.67 -47.28 58.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.0 ttm-85 -70.39 -30.08 66.89 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.87 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.47 -47.4 79.29 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.965 0.906 . . . . 0.0 112.162 174.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.48 94.86 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.091 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.18 -45.55 87.89 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-O 121.351 0.596 . . . . 0.0 109.51 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -56.34 -41.79 76.65 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 126.571 1.948 . . . . 0.0 111.987 -179.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.1 p -73.39 -27.06 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.118 -177.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -84.33 -60.06 2.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.647 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -79.59 81.86 5.79 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 121.981 0.896 . . . . 0.0 110.833 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -79.1 -38.43 36.24 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.493 -1.231 . . . . 0.0 111.987 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -73.55 -13.87 61.1 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 121.28 0.562 . . . . 0.0 111.036 -176.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.41 60.25 4.15 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.993 175.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 37.5 m-80 -99.33 -10.29 22.49 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.03 0.443 . . . . 0.0 110.755 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.82 1.88 84.73 Favored Glycine 0 CA--C 1.498 -0.982 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -153.5 150.13 28.43 Favored 'General case' 0 N--CA 1.412 -2.356 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.487 ' HB ' HG11 ' A' ' 136' ' ' VAL . 5.4 mt -98.55 124.36 51.66 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.114 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.1 m -101.59 159.04 15.64 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.08 -42.12 89.67 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.16 -44.3 89.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.295 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.609 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 3.1 tp10 -59.11 -46.76 87.48 Favored 'General case' 0 CA--C 1.494 -1.184 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.898 176.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.532 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.7 tt -62.3 -36.63 82.72 Favored 'General case' 0 N--CA 1.418 -2.039 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -174.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.2 -32.53 71.88 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.609 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 48.0 m170 -53.49 -55.61 23.91 Favored 'General case' 0 C--O 1.26 1.658 0 CA-C-O 121.478 0.656 . . . . 0.0 110.117 177.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.413 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.7 p -65.79 -34.68 71.94 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.06 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.538 -178.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.532 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 19.8 mmt -62.13 -43.11 99.56 Favored 'General case' 0 CA--C 1.491 -1.324 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 m -59.43 -37.78 78.95 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.033 177.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -79.02 -22.91 44.75 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.2 177.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 93.0 mt -84.96 -20.0 31.27 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.778 0.323 . . . . 0.0 110.81 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 103.0 2.67 48.85 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.569 178.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -85.3 115.73 23.23 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.326 0.584 . . . . 0.0 111.279 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -85.8 76.13 9.95 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.411 HD12 ' HG3' ' A' ' 109' ' ' MET . 66.2 mt -101.14 147.54 26.13 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.011 -177.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.9 p -83.86 165.76 18.49 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.144 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -64.78 -39.28 93.35 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -54.5 -49.71 69.52 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.169 176.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -59.4 -54.5 45.95 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.902 -176.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 125' ' ' ILE . 18.3 m -65.78 -35.79 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.378 -175.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.573 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 11.3 t70 -66.85 -42.06 86.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.357 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -69.92 -29.15 66.25 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.172 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 66.3 mtt -58.89 -49.66 76.95 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 173.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.9 mm -53.37 -46.44 58.07 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.603 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.661 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.573 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 27.5 mmt180 -62.07 -32.34 72.86 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -175.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -79.38 -35.89 40.09 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 120.1 -0.64 . . . . 0.0 111.241 178.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.419 ' HA ' ' HG2' ' A' ' 144' ' ' MET . . . -79.81 -21.36 44.36 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 121.706 0.765 . . . . 0.0 110.467 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -82.5 88.39 6.63 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.408 173.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 61.4 mt -81.85 -42.62 19.29 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -75.8 -9.29 58.47 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.8 53.84 3.86 Favored Glycine 0 N--CA 1.438 -1.213 0 C-N-CA 120.545 -0.836 . . . . 0.0 111.813 175.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -105.38 -10.35 17.03 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 90.72 -8.81 79.25 Favored Glycine 0 CA--C 1.499 -0.941 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.115 176.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -141.35 138.3 32.97 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.487 HG11 ' HB ' ' A' ' 100' ' ' ILE . 0.8 OUTLIER -81.78 114.67 23.06 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 N-CA-C 113.159 0.799 . . . . 0.0 113.159 -175.446 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -90.66 163.62 14.46 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.749 ' O ' HG21 ' A' ' 142' ' ' VAL . 47.4 t80 -55.5 -59.92 4.15 Favored 'General case' 0 C--O 1.198 -1.62 0 CA-C-O 117.96 -1.019 . . . . 0.0 113.165 -174.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -53.71 -37.15 62.99 Favored 'General case' 0 CA--C 1.561 1.399 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -172.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -73.95 -35.07 64.52 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 120.121 -0.631 . . . . 0.0 110.44 178.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -66.51 -41.74 88.4 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.182 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.749 HG21 ' O ' ' A' ' 138' ' ' TYR . 6.3 t -52.6 -43.03 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.424 0 C-N-CA 124.47 1.108 . . . . 0.0 109.841 177.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -66.82 -55.92 12.7 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.92 -178.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.419 ' HG2' ' HA ' ' A' ' 128' ' ' ALA . 3.1 ppp? -76.47 -20.45 56.99 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -174.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.7 ttt -73.16 -35.39 66.44 Favored 'General case' 0 C--O 1.242 0.689 0 CA-C-O 120.971 0.415 . . . . 0.0 110.117 175.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 25.1 p -86.75 -40.51 14.95 Favored 'General case' 0 N--CA 1.435 -1.207 0 C-N-CA 119.763 -0.775 . . . . 0.0 110.186 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -96.41 89.31 5.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 121.712 0.768 . . . . 0.0 109.884 179.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.584 ' HD2' ' O ' ' A' ' 148' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.297 -1.702 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.116 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -77.65 -82.75 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 121.661 1.574 . . . . 0.0 111.754 178.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -175.18 -174.12 0.72 Allowed 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 -179.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -137.77 -18.5 1.22 Allowed 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 120.794 0.331 . . . . 0.0 111.076 178.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.9 m -85.19 16.35 3.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.51 0.671 . . . . 0.0 111.392 -177.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -120.16 29.2 7.62 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 176.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -59.74 -24.5 64.08 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.363 -176.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -57.18 -45.48 83.66 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 174.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . 0.57 ' O ' ' HG3' ' B' ' 86' ' ' LYS . 13.0 mptt -74.27 -30.75 62.26 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.295 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.47 -36.97 85.9 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 174.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.47 -46.21 80.68 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.508 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -61.65 -24.91 67.04 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . 0.619 ' HG2' ' OE1' ' B' ' 90' ' ' GLN . 67.1 mttm -68.79 -31.42 70.42 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.163 0.506 . . . . 0.0 110.549 175.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . 0.548 ' O ' ' HB3' ' B' ' 91' ' ' LYS . 74.8 m80 -84.07 -29.7 26.62 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.555 177.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -86.4 -63.15 1.36 Allowed 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -177.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 64.7 mt -81.57 -58.39 3.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 O-C-N 122.198 -0.314 . . . . 0.0 111.085 -173.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . 0.619 ' OE1' ' HG2' ' B' ' 86' ' ' LYS . 46.3 mt-30 -59.1 -36.06 74.5 Favored 'General case' 0 C--O 1.202 -1.421 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.163 -178.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . 0.548 ' HB3' ' O ' ' B' ' 87' ' ' HIS . 20.3 tptp -80.67 -33.31 35.61 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.13 -46.44 77.51 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.571 0.7 . . . . 0.0 110.744 179.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.2 mmmt -91.53 9.61 31.34 Favored 'General case' 0 C--O 1.196 -1.727 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.937 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . 0.458 ' HB2' ' O ' ' B' ' 90' ' ' GLN . 8.5 t-80 -75.37 -13.31 60.4 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -173.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.524 ' HG3' ' O ' ' A' ' 35' ' ' VAL . 19.4 tpp -134.25 -42.92 0.03 OUTLIER Pre-proline 0 C--N 1.293 -1.854 0 C-N-CA 119.316 -0.953 . . . . 0.0 112.975 -170.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -79.31 7.6 4.35 Favored 'Trans proline' 0 C--N 1.379 2.177 0 C-N-CA 121.411 1.407 . . . . 0.0 111.417 175.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -160.26 146.68 11.9 Favored Pre-proline 0 C--N 1.31 -1.136 0 N-CA-C 104.725 -2.324 . . . . 0.0 104.725 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -75.04 89.98 1.12 Allowed 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 121.013 1.142 . . . . 0.0 113.213 176.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . 0.423 ' NE1' ' HG2' ' B' ' 90' ' ' GLN . 3.1 t90 -132.18 137.04 47.47 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 176.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . 0.41 ' HB2' ' HB2' ' A' ' 15' ' ' ALA . . . . . . . . 0 C--N 1.301 -1.507 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.45 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.312 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -119.88 -17.96 8.36 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.053 0.454 . . . . 0.0 110.049 176.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -112.7 159.12 19.24 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 177.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.1 tp -131.82 147.78 52.51 Favored 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.863 -175.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.9 p -74.68 142.84 44.44 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -67.25 -30.25 70.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -171.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -63.43 -40.09 96.24 Favored 'General case' 0 C--O 1.245 0.859 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 177.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.424 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 6.6 tp-100 -72.95 -36.32 67.15 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.376 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.459 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 64.7 mt -61.64 -37.84 78.88 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.945 176.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.1 -43.12 99.36 Favored 'General case' 0 C--O 1.256 1.408 0 CA-C-O 121.646 0.736 . . . . 0.0 110.371 176.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -60.62 -41.24 94.46 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.611 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.424 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 21.3 m-85 -74.96 -12.0 60.24 Favored 'General case' 0 C--O 1.189 -2.125 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 177.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 67.7 mttm -69.58 -48.81 58.92 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 173.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.72 -39.91 88.18 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 119.699 -0.8 . . . . 0.0 110.084 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.56 -24.14 63.66 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.409 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.577 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 70.1 t80 -68.52 -52.34 33.12 Favored 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 176.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 m -69.55 -16.69 63.47 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.15 -178.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.78 -31.86 72.91 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 173.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.526 ' CD2' HG23 ' A' ' 35' ' ' VAL . 8.8 m-85 -98.29 -43.13 7.08 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.771 177.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -79.43 87.44 5.06 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 122.143 0.973 . . . . 0.0 109.222 176.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 27.5 mmmt -71.27 -26.22 62.8 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 114.046 -1.434 . . . . 0.0 112.358 -172.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.602 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 1.5 m-20 -90.98 -13.17 33.88 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.754 -177.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.46 58.41 9.46 Favored Glycine 0 C--O 1.223 -0.564 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.404 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.602 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 10.3 m-20 -112.12 -16.74 12.97 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -176.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.31 11.4 58.48 Favored Glycine 0 C--N 1.313 -0.722 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 -173.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.2 p -144.7 136.83 26.09 Favored 'General case' 0 N--CA 1.441 -0.925 0 C-N-CA 123.369 0.668 . . . . 0.0 110.167 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 56.9 mt -104.87 127.92 59.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 p -103.18 172.91 6.55 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.922 177.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.3 p -64.34 -27.98 69.4 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.881 0.372 . . . . 0.0 111.182 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -53.18 -54.01 42.12 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 124.553 1.141 . . . . 0.0 109.392 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.508 ' HB3' ' O ' ' A' ' 19' ' ' PHE . 35.1 mt-10 -71.2 -38.81 72.05 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 113.719 -1.582 . . . . 0.0 111.271 -174.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -59.32 -49.39 78.0 Favored 'General case' 0 C--O 1.208 -1.112 0 O-C-N 123.447 0.467 . . . . 0.0 110.907 176.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.13 -27.67 72.61 Favored Glycine 0 C--O 1.222 -0.613 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.465 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.2 m -65.7 -50.08 66.18 Favored 'General case' 0 C--O 1.262 1.739 0 CA-C-O 121.693 0.759 . . . . 0.0 109.591 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.689 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 34.8 m -73.35 -41.08 57.3 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.194 -178.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -48.12 75.61 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 123.166 0.587 . . . . 0.0 110.948 177.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -58.26 -39.56 79.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.943 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.8 m -68.63 -27.32 65.91 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 121.328 0.585 . . . . 0.0 111.164 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 52.3 mt -84.1 -20.27 32.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.324 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.22 19.02 40.43 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -106.07 120.56 42.1 Favored 'General case' 0 N--CA 1.428 -1.573 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -126.11 69.23 66.34 Favored Pre-proline 0 C--N 1.301 -1.539 0 C-N-CA 118.663 -1.215 . . . . 0.0 112.866 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -77.25 163.12 30.63 Favored 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 122.293 1.995 . . . . 0.0 109.875 175.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.411 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 22.8 p -75.29 161.77 29.01 Favored 'General case' 0 C--N 1.295 -1.804 0 CA-C-O 120.46 0.172 . . . . 0.0 111.163 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -57.39 -36.1 70.85 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 177.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.17 -49.69 76.13 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.464 178.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.411 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 8.1 mm-40 -64.22 -42.59 96.52 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.755 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.34 -45.72 89.92 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.557 0.535 . . . . 0.0 111.48 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.4 tm0? -66.63 -40.12 88.6 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -62.46 -38.06 88.36 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.978 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 21.7 mmt -58.49 -40.07 81.78 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.21 175.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.9 mt -67.28 -56.54 13.13 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.15 176.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -57.34 -26.2 60.61 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.488 0.715 . . . . 0.0 112.554 -173.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.57 -46.11 89.83 Favored 'General case' 0 N--CA 1.427 -1.621 0 C-N-CA 123.113 0.565 . . . . 0.0 109.503 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.589 HG12 ' SD ' ' A' ' 71' ' ' MET . 35.3 m -93.71 -19.77 6.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.274 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -67.89 106.84 2.43 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.184 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.55 -9.71 53.65 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.582 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -101.71 -12.56 18.28 Favored 'General case' 0 CA--C 1.497 -1.088 0 C-N-CA 119.263 -0.975 . . . . 0.0 110.284 -173.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 61.23 39.09 96.7 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -172.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -108.14 -2.23 19.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.867 0.365 . . . . 0.0 110.963 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.52 9.14 82.07 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 121.088 -0.577 . . . . 0.0 114.308 172.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 26.2 p -134.88 150.94 50.52 Favored 'General case' 0 C--O 1.256 1.416 0 CA-C-N 117.5 0.65 . . . . 0.0 111.58 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 45.8 mt -91.88 106.64 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 176.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -77.16 163.86 26.19 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.416 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 48.5 t80 -52.01 -53.83 47.47 Favored Pre-proline 0 CA--C 1.561 1.377 0 O-C-N 123.681 0.613 . . . . 0.0 112.33 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.408 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 10.3 Cg_endo -52.44 -38.49 74.16 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.988 2.459 . . . . 0.0 113.341 176.043 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -71.2 -43.37 67.53 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 121.243 0.544 . . . . 0.0 110.142 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.577 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 56.5 t80 -62.57 -41.77 99.14 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.455 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 91.4 mt -63.17 -49.49 74.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.749 177.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.7 m -57.75 -46.94 83.8 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.589 ' SD ' HG12 ' A' ' 55' ' ' VAL . 16.6 ptt? -67.72 -32.07 72.45 Favored 'General case' 0 CA--C 1.507 -0.692 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.374 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.1 tpp -71.22 -37.27 72.05 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.73 -30.11 71.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.613 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -75.41 -28.69 59.52 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.019 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.478 ' HG3' ' O ' ' A' ' 71' ' ' MET . 94.4 mttt -69.85 -29.75 67.07 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.062 -179.226 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -88.75 94.65 9.98 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 166.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -44.9 -82.96 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.319 1.448 . . . . 0.0 112.948 -172.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -154.47 27.09 0.45 Allowed 'General case' 0 CA--C 1.475 -1.913 0 CA-C-O 124.519 2.104 . . . . 0.0 106.051 176.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.413 ' HB ' ' HB2' ' A' ' 83' ' ' GLU . 1.8 p -150.44 132.51 15.29 Favored 'General case' 1 N--CA 1.369 -4.496 0 CA-C-N 110.925 -2.852 . . . . 0.0 105.55 -177.873 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -128.74 -45.59 1.3 Allowed 'General case' 0 C--N 1.305 -1.35 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.656 178.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.2 m -70.25 -35.88 74.1 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.532 -173.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -101.53 -25.92 13.73 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.182 0.515 . . . . 0.0 111.614 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.413 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 27.2 tp10 -66.53 -46.32 76.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.681 -175.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -59.39 -43.68 92.91 Favored 'General case' 0 CA--C 1.501 -0.928 0 O-C-N 124.119 0.887 . . . . 0.0 110.666 -176.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.648 ' HA ' ' SD ' ' A' ' 145' ' ' MET . 7.0 mm -63.95 -49.64 80.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.574 -1.193 . . . . 0.0 109.302 -174.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -69.21 -33.43 73.31 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.969 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -63.74 -53.28 53.52 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.16 -46.01 91.13 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.787 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -60.44 -48.14 83.05 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.096 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.594 ' HA ' ' NE ' ' A' ' 90' ' ' ARG . 0.8 OUTLIER -60.23 -36.66 78.22 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.187 -178.169 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.7 p -75.89 -26.01 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 120.516 -0.474 . . . . 0.0 111.602 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -80.88 -56.32 4.2 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 176.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -88.9 86.15 6.89 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 122.009 0.909 . . . . 0.0 109.201 178.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -78.02 -21.6 50.51 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.249 -174.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.536 ' HB3' ' ND2' ' A' ' 97' ' ' ASN . 13.3 t70 -83.52 -15.13 50.56 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -177.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.501 ' HA2' ' NH2' ' A' ' 90' ' ' ARG . . . 72.06 51.18 14.98 Favored Glycine 0 N--CA 1.44 -1.057 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.804 179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.536 ' ND2' ' HB3' ' A' ' 95' ' ' ASP . 39.6 m-80 -84.1 -19.61 33.96 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.832 0.348 . . . . 0.0 110.168 -178.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.68 -2.91 86.71 Favored Glycine 0 C--O 1.227 -0.319 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.438 ' CE1' ' HB2' ' A' ' 137' ' ' ASN . 91.9 m-85 -143.47 150.11 38.51 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.2 mt -111.36 133.16 57.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 177.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.2 m -98.7 156.96 16.57 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.69 -49.48 62.52 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -173.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.26 -33.75 76.73 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 36.3 tt0 -64.96 -46.97 79.33 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.469 176.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.445 ' O ' HG12 ' A' ' 108' ' ' VAL . 9.1 tt -65.31 -36.51 84.29 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.441 ' HA ' HG13 ' A' ' 121' ' ' VAL . 26.1 ttp180 -62.38 -38.44 89.6 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.322 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.427 ' HB2' ' O ' ' A' ' 104' ' ' GLU . 44.0 m170 -61.62 -54.2 46.02 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.067 176.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 105' ' ' LEU . 6.3 p -61.98 -36.36 73.59 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.55 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.659 -178.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.433 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.3 mmt -64.28 -41.41 96.92 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-O 121.011 0.434 . . . . 0.0 111.08 178.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.2 m -66.07 -33.88 76.79 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 178.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -75.1 -25.17 58.31 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.539 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.4 mt -87.93 -20.36 26.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.333 0.587 . . . . 0.0 110.721 -178.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.39 -14.06 43.29 Favored Glycine 0 C--N 1.305 -1.149 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.898 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.476 ' CD ' ' HZ3' ' B' ' 91' ' ' LYS . 1.1 mp0 -61.85 -42.57 99.21 Favored 'General case' 0 CA--C 1.504 -0.825 0 C-N-CA 123.043 0.537 . . . . 0.0 110.053 177.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 54.5 35.83 24.28 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.454 1.096 . . . . 0.0 111.314 176.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.5 mt -57.95 143.31 43.41 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.246 -177.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 16.7 p -70.21 168.39 15.86 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 123.599 0.562 . . . . 0.0 110.539 178.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -62.81 -35.39 79.76 Favored 'General case' 0 C--O 1.215 -0.735 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -177.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -53.33 -54.58 34.44 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.546 1.138 . . . . 0.0 111.024 176.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -71.69 -38.37 70.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.118 -175.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.441 HG13 ' HA ' ' A' ' 106' ' ' ARG . 11.9 m -70.95 -33.94 53.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.891 -178.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -71.97 -36.36 69.79 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -60.96 -46.37 90.99 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 175.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.425 ' SD ' HD23 ' A' ' 105' ' ' LEU . 35.5 mtt -53.53 -50.45 65.45 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.735 175.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.41 HG12 ' O ' ' A' ' 121' ' ' VAL . 47.3 mm -63.2 -57.2 12.99 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.506 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.557 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -54.95 -42.23 72.07 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -171.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.498 ' HB2' ' CE1' ' B' ' 81' ' ' PHE . 21.3 mm-40 -74.67 -30.77 61.7 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -84.0 -27.28 28.53 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.339 0.59 . . . . 0.0 110.502 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.445 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 7.7 t70 -67.66 96.17 0.53 Allowed 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 125.626 1.57 . . . . 0.0 109.419 175.123 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.1 mt -82.68 -48.49 17.88 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.836 -176.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.86 -11.3 60.88 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 121.137 0.494 . . . . 0.0 112.245 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.445 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 72.9 47.06 26.78 Favored Glycine 0 C--N 1.306 -1.105 0 N-CA-C 110.814 -0.914 . . . . 0.0 110.814 178.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -98.73 -16.41 18.98 Favored 'General case' 0 C--N 1.306 -1.309 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -178.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.1 10.39 61.15 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -147.77 134.17 19.64 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 124.729 1.212 . . . . 0.0 107.92 -176.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.417 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 0.7 OUTLIER -88.02 121.56 38.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 CA-C-O 120.564 0.221 . . . . 0.0 111.392 -179.491 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.438 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 20.5 t30 -85.77 154.47 21.58 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.304 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.535 ' O ' HG11 ' A' ' 142' ' ' VAL . 42.1 t80 -56.01 -47.55 77.57 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.336 1.054 . . . . 0.0 110.407 178.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.55 -21.62 66.74 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.696 -178.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -87.97 -42.9 12.15 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 122.027 0.917 . . . . 0.0 108.734 177.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -65.9 -28.26 68.81 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.1 -177.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.535 HG11 ' O ' ' A' ' 138' ' ' TYR . 34.6 m -60.34 -29.15 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-O 121.085 0.469 . . . . 0.0 111.638 177.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -79.93 -44.97 19.38 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-O 121.578 0.704 . . . . 0.0 109.586 178.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 90.9 mmm -66.6 -44.22 82.69 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 114.866 -1.061 . . . . 0.0 112.653 -176.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.648 ' SD ' ' HA ' ' A' ' 85' ' ' ILE . 28.3 ttt -66.02 -33.77 76.56 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -177.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 9.2 t -86.53 0.27 54.66 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.252 0.549 . . . . 0.0 110.696 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -82.74 93.39 7.4 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt . . . . . 0 C--N 1.307 -1.255 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 -178.555 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 30.0 m . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -63.18 -60.21 0.18 Allowed 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.056 1.837 . . . . 0.0 112.03 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -126.03 -50.22 1.57 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 54.27 93.39 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.206 1.402 . . . . 0.0 110.803 -178.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 50.1 m -74.81 24.34 0.09 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -176.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 68.65 -64.53 0.31 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.339 1.455 . . . . 0.0 114.099 176.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -68.0 -21.53 65.04 Favored 'General case' 0 C--O 1.208 -1.096 0 C-N-CA 120.308 -0.557 . . . . 0.0 109.802 -178.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . 0.498 ' CE1' ' HB2' ' A' ' 127' ' ' GLU . 40.5 t80 -49.82 -43.5 48.78 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 124.931 1.292 . . . . 0.0 110.549 172.237 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -70.73 -47.15 61.23 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -176.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -60.99 -40.52 93.8 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.598 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.61 -49.75 69.86 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.801 -179.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.4 ' O ' HG12 ' B' ' 89' ' ' ILE . 64.8 m95 -59.71 -39.74 85.63 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.92 177.201 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -53.63 -59.78 4.16 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 122.004 0.907 . . . . 0.0 109.262 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -62.37 -38.0 87.87 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.158 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.08 -51.8 66.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.448 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 85' ' ' TRP . 26.9 pt -66.12 -34.24 68.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.736 -0.386 . . . . 0.0 111.789 -177.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -59.33 -43.89 92.67 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.139 0.495 . . . . 0.0 110.285 175.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . 0.476 ' HZ3' ' CD ' ' A' ' 114' ' ' GLU . 5.6 tppp? -75.02 -45.44 41.74 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.312 -178.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.13 -41.62 97.14 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -174.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -64.52 -34.01 77.24 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.282 0.563 . . . . 0.0 110.389 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . 0.426 ' HD2' ' O ' ' B' ' 95' ' ' MET . 7.2 t60 -66.97 137.02 56.21 Favored 'General case' 0 CA--C 1.56 1.364 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.176 -176.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.503 ' HB3' ' CD ' ' B' ' 96' ' ' PRO . 64.5 mtt -114.75 -157.51 0.03 OUTLIER Pre-proline 0 CA--C 1.573 1.861 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.503 ' CD ' ' HB3' ' B' ' 95' ' ' MET . 17.2 Cg_exo -74.67 19.27 0.47 Allowed 'Trans proline' 0 C--N 1.372 1.78 0 CA-C-N 123.487 2.281 . . . . 0.0 112.11 172.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . 0.454 ' H ' ' C ' ' B' ' 95' ' ' MET . 8.5 p-10 -104.09 169.38 7.34 Favored Pre-proline 0 C--N 1.308 -1.217 0 C-N-CA 125.067 1.347 . . . . 0.0 109.577 -175.042 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -85.97 93.62 0.6 Allowed 'Trans proline' 0 N--CA 1.435 -1.96 0 C-N-CA 122.347 2.032 . . . . 0.0 109.2 171.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 2.5 t90 -117.76 130.62 56.41 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 107.243 -1.392 . . . . 0.0 107.243 -175.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . 0.428 ' HB3' ' CZ ' ' A' ' 68' ' ' PHE . . . . . . . . 0 C--N 1.288 -2.092 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.384 0 CA-C-O 120.195 0.045 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -129.74 98.1 4.71 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.448 ' H ' ' HB1' ' A' ' 73' ' ' ALA . 28.0 mt-30 -135.44 85.91 2.2 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 173.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.429 HD22 HG12 ' A' ' 9' ' ' ILE . 6.0 tp -132.96 126.83 32.88 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -177.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 16.7 p -74.64 154.18 38.62 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.439 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 1.7 mp0 -53.33 -45.23 68.99 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.546 0.738 . . . . 0.0 111.331 -175.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -66.3 -34.32 77.73 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.059 0.457 . . . . 0.0 110.685 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.416 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 8.8 tp-100 -72.23 -36.17 69.05 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.482 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 62.7 mt -66.64 -34.59 71.07 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.852 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.667 175.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.61 98.91 Favored 'General case' 0 C--O 1.267 2.016 0 C-N-CA 123.128 0.571 . . . . 0.0 110.587 174.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 8' ' ' GLN . 42.6 mm-40 -55.64 -49.06 73.87 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 174.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -68.63 -25.9 65.07 Favored 'General case' 0 C--O 1.187 -2.224 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.311 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 32.9 mmtp -56.48 -56.89 15.59 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 175.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -71.15 -40.77 71.16 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.786 -177.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.13 -30.96 71.93 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.323 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -68.08 -44.48 76.19 Favored 'General case' 0 C--O 1.204 -1.315 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.6 m -63.35 -25.68 68.41 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 120.969 0.414 . . . . 0.0 111.509 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -67.17 -36.99 82.98 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.467 ' CD2' HG21 ' A' ' 35' ' ' VAL . 26.0 m-85 -88.17 -38.41 15.34 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.573 -179.048 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -78.2 99.39 6.21 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 176.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -77.93 -5.23 50.42 Favored 'General case' 0 C--N 1.287 -2.143 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.069 -173.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.63 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 4.1 m-20 -116.98 -13.72 10.63 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.51 53.98 25.49 Favored Glycine 0 CA--C 1.524 0.618 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.881 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.63 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 3.6 m-20 -110.66 -17.79 13.31 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 117.233 0.516 . . . . 0.0 110.241 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.38 21.08 39.09 Favored Glycine 0 N--CA 1.439 -1.165 0 N-CA-C 109.299 -1.521 . . . . 0.0 109.299 -173.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.3 p -146.7 130.98 17.49 Favored 'General case' 0 C--O 1.252 1.229 0 C-N-CA 123.87 0.868 . . . . 0.0 109.613 -178.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 75.1 mt -113.35 121.46 65.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.531 ' OG1' ' HB3' ' A' ' 30' ' ' LYS . 17.9 p -93.83 175.51 6.7 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.282 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.3 p -66.78 -26.58 67.03 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-O 121.316 0.579 . . . . 0.0 109.687 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.531 ' HB3' ' OG1' ' A' ' 28' ' ' THR . 35.4 tttm -49.56 -59.31 3.89 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.401 1.48 . . . . 0.0 109.107 171.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -71.61 -35.77 70.58 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.387 -174.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.5 mt -58.21 -52.04 67.23 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.58 0.55 . . . . 0.0 109.753 175.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.85 -30.13 76.52 Favored Glycine 0 C--O 1.216 -1.0 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.243 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.4 m -59.74 -53.37 58.75 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-O 120.897 0.38 . . . . 0.0 110.624 177.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.473 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 34.2 m -70.28 -34.32 58.02 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.369 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.93 -178.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.456 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 49.6 mtt -68.92 -34.94 76.2 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.969 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.0 ttp85 -60.31 -41.9 94.43 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -64.79 -32.3 73.93 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.741 176.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 90.4 mt -84.36 -5.43 59.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.422 -178.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.15 25.46 37.04 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 116.391 -0.368 . . . . 0.0 113.508 178.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -125.59 133.94 52.1 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.65 83.65 35.61 Favored Pre-proline 0 C--N 1.301 -1.507 0 O-C-N 122.226 -0.297 . . . . 0.0 110.513 176.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.456 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 6.1 Cg_exo -82.64 154.34 15.62 Favored 'Trans proline' 0 C--O 1.24 0.616 0 C-N-CA 123.121 2.547 . . . . 0.0 111.251 176.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.9 p -86.19 161.74 18.68 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -46.92 -58.96 3.42 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.894 1.678 . . . . 0.0 112.361 -175.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.49 -29.86 70.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 51' ' ' MET . 8.1 mm-40 -68.94 -45.29 71.14 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.404 ' O ' HG13 ' A' ' 52' ' ' ILE . 79.1 mt -62.8 -41.2 99.17 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.616 -1.175 . . . . 0.0 109.323 177.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -56.1 -48.09 76.81 Favored 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 123.504 0.722 . . . . 0.0 111.269 176.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -63.66 -37.44 87.36 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 120.613 0.244 . . . . 0.0 111.016 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.582 ' SD ' ' HD2' ' B' ' 96' ' ' PRO . 28.1 mmt -59.59 -48.1 83.0 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 48' ' ' LEU . 61.1 mt -61.04 -45.28 98.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.153 177.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -60.3 -14.84 20.36 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 125.108 1.363 . . . . 0.0 114.49 -176.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -69.76 -39.29 76.8 Favored 'General case' 0 N--CA 1.408 -2.534 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 177.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.477 HG13 ' HB2' ' A' ' 71' ' ' MET . 18.7 m -110.49 -15.86 9.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.028 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.742 -174.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -71.49 104.91 3.4 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -177.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.41 -26.6 24.65 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.173 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.73 -11.93 38.14 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -176.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 59.63 60.7 8.27 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.787 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -108.03 -17.36 14.06 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.81 23.51 38.63 Favored Glycine 0 N--CA 1.426 -1.986 0 N-CA-C 109.207 -1.557 . . . . 0.0 109.207 -172.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 57.3 p -139.14 136.11 34.77 Favored 'General case' 0 C--O 1.27 2.165 0 C-N-CA 122.593 0.357 . . . . 0.0 110.321 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 54.6 mt -91.7 104.7 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.127 0 N-CA-C 105.003 -2.221 . . . . 0.0 105.003 174.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -82.49 153.4 25.61 Favored 'General case' 0 C--N 1.285 -2.213 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 -176.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.41 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 76.1 t80 -45.08 -52.73 18.82 Favored Pre-proline 0 N--CA 1.487 1.4 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -176.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.41 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 7.1 Cg_endo -49.54 -42.64 41.72 Favored 'Trans proline' 0 C--N 1.367 1.537 0 C-N-CA 122.842 2.361 . . . . 0.0 112.65 175.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -73.47 -34.09 65.19 Favored 'General case' 0 CA--C 1.508 -0.664 0 C-N-CA 122.884 0.473 . . . . 0.0 110.304 -178.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -62.8 -39.5 94.46 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.14 -47.47 79.83 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.858 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.4 m -57.64 -41.52 81.55 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.418 0.687 . . . . 0.0 110.281 178.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.477 ' HB2' HG13 ' A' ' 55' ' ' VAL . 31.5 ttp -57.58 -45.01 85.78 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.204 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 26.3 mmt -77.42 -38.88 48.72 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.508 -177.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 78' ' ' ASP . . . -59.44 -46.48 88.62 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 123.35 0.407 . . . . 0.0 111.137 179.236 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 66.2 mtp180 -56.42 -31.64 64.1 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.602 0.715 . . . . 0.0 111.758 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -88.13 -25.81 22.8 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.459 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.2 ttp -126.59 109.44 12.12 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.699 -175.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? 77.08 -51.04 0.56 Allowed 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 114.382 1.252 . . . . 0.0 114.382 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.516 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 11.1 t70 -77.98 156.47 30.16 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 178.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 41.4 m 61.81 60.97 1.48 Allowed 'General case' 0 CA--C 1.553 1.079 0 CA-C-O 122.603 1.192 . . . . 0.0 109.794 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.409 ' C ' ' H ' ' A' ' 82' ' ' GLU . 5.4 p-10 -94.02 22.85 5.38 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.996 0.903 . . . . 0.0 109.729 -179.32 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 p -75.2 13.27 0.74 Allowed 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 125.111 1.365 . . . . 0.0 111.806 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.409 ' H ' ' C ' ' A' ' 80' ' ' ASP . 40.1 mt-10 73.47 -1.71 2.97 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 126.274 1.829 . . . . 0.0 111.953 177.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.1 -46.23 90.3 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -175.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -67.52 -35.9 79.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.036 0.446 . . . . 0.0 110.882 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.9 mm -73.3 -41.68 57.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-O 121.952 0.882 . . . . 0.0 109.217 -176.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -74.25 -34.09 63.5 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.831 -178.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.17 -46.89 88.65 Favored 'General case' 0 CA--C 1.501 -0.905 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.439 ' O ' HG11 ' A' ' 91' ' ' VAL . . . -56.37 -45.77 80.37 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 113.911 -1.495 . . . . 0.0 110.943 177.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -67.21 -45.84 75.64 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 119.739 -0.784 . . . . 0.0 110.863 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -67.07 -22.56 65.84 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -177.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.439 HG11 ' O ' ' A' ' 88' ' ' ALA . 8.1 p -78.88 -21.65 12.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 C-N-CA 119.771 -0.771 . . . . 0.0 110.067 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -94.47 -39.24 10.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.48 175.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -109.27 92.65 4.13 Favored 'General case' 0 C--O 1.245 0.823 0 CA-C-O 121.8 0.81 . . . . 0.0 109.589 174.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -51.47 9.73 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 114.06 -1.427 . . . . 0.0 111.899 -174.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -85.4 -12.37 52.24 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -171.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.23 55.12 1.75 Allowed Glycine 0 N--CA 1.432 -1.612 0 C-N-CA 119.771 -1.204 . . . . 0.0 110.997 177.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -83.21 -18.38 39.5 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.58 -15.54 40.71 Favored Glycine 0 CA--C 1.501 -0.803 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.595 175.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.518 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 73.0 m-85 -140.04 134.4 31.34 Favored 'General case' 0 N--CA 1.417 -2.079 0 N-CA-C 107.275 -1.379 . . . . 0.0 107.275 -179.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.0 mt -75.27 135.52 27.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.713 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 177.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.5 m -105.97 139.58 40.29 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -177.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.55 -47.7 80.52 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.613 0.598 . . . . 0.0 112.613 -175.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.6 -43.14 97.77 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.675 -178.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -66.09 -40.86 91.14 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.099 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.5 ' O ' ' HG2' ' A' ' 109' ' ' MET . 7.0 tt -62.59 -39.28 93.22 Favored 'General case' 0 C--O 1.215 -0.75 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -68.34 -30.37 69.31 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.305 0.574 . . . . 0.0 109.943 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -69.88 -45.04 68.55 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.736 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.57 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.7 p -64.59 -29.23 46.78 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.471 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.5 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 19.3 mmt -59.53 -49.61 77.13 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 177.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 23.0 m -60.09 -34.77 73.92 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 121.001 0.429 . . . . 0.0 110.061 177.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -70.77 -33.49 70.83 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.087 0.555 . . . . 0.0 110.906 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 72.6 mt -81.4 -8.17 59.69 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.335 0.588 . . . . 0.0 110.565 -178.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.36 19.45 30.2 Favored Glycine 0 N--CA 1.432 -1.612 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.996 179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -98.55 177.02 5.46 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -151.28 48.07 0.83 Allowed 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.928 0.871 . . . . 0.0 109.162 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.2 mt -76.16 143.99 40.83 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.186 -176.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 44.4 p -78.0 170.61 16.31 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.256 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -70.17 -20.65 63.12 Favored 'General case' 0 C--O 1.206 -1.234 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.907 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -71.39 -45.05 63.78 Favored 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 123.485 0.491 . . . . 0.0 110.28 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -65.24 -45.3 85.18 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.964 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 12.8 m -72.57 -27.89 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.39 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.62 -46.29 79.84 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.664 174.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -64.1 -34.19 77.48 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.556 -177.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 65.2 mtt -57.7 -57.72 11.51 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.179 175.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.5 mm -61.56 -56.43 17.84 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.186 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.857 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 -53.01 -44.06 67.0 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 124.909 1.283 . . . . 0.0 113.285 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.629 ' HB2' ' CE1' ' B' ' 81' ' ' PHE . 59.2 mm-40 -87.06 -7.77 57.75 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.957 -175.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -95.43 -30.79 13.7 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 173.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -66.21 102.37 0.83 Allowed 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 125.772 1.629 . . . . 0.0 109.013 173.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.4 mt -81.76 -44.65 20.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.766 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.941 -174.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -73.73 -11.58 60.44 Favored 'General case' 0 C--O 1.243 0.717 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.43 44.72 20.87 Favored Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.51 -0.853 . . . . 0.0 111.252 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -98.03 -16.18 19.73 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.106 0.479 . . . . 0.0 110.126 -177.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.52 4.27 64.13 Favored Glycine 0 C--O 1.241 0.571 0 C-N-CA 120.463 -0.875 . . . . 0.0 111.107 -177.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.518 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 41.7 mt-30 -137.73 151.61 48.38 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 1.3 p -114.7 116.33 52.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 C-N-CA 119.898 -0.721 . . . . 0.0 112.893 -179.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.42 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 27.9 t30 -75.55 157.57 33.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.311 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -50.52 -49.04 56.78 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.359 1.064 . . . . 0.0 110.726 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -64.02 -24.73 67.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.985 -177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -85.1 -42.21 15.01 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -63.25 -44.62 94.65 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.431 178.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.92 -30.19 49.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.68 0.276 . . . . 0.0 111.735 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -71.15 -44.06 66.31 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 121.614 0.721 . . . . 0.0 109.935 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 12.9 tmm? -75.41 -40.0 58.35 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.342 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.8 ttt -68.25 -26.65 65.79 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -178.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 16.3 p -80.71 -17.08 52.21 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.245 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -101.83 100.21 10.51 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 97.3 mttt . . . . . 0 C--O 1.25 1.098 0 C-N-CA 125.359 1.464 . . . . 0.0 111.675 -178.395 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.436 -1.167 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -73.92 37.11 0.42 Allowed 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 123.698 2.932 . . . . 0.0 112.64 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -131.97 31.16 4.21 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.466 -175.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -94.31 -44.31 8.0 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 174.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 49.9 m -105.19 -10.87 16.83 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.284 174.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 60.33 29.53 19.08 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.4 1.08 . . . . 0.0 111.316 175.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -141.39 15.23 2.2 Favored 'General case' 0 C--O 1.208 -1.109 0 C-N-CA 118.785 -1.166 . . . . 0.0 111.466 -173.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . 0.629 ' CE1' ' HB2' ' A' ' 127' ' ' GLU . 49.6 t80 -48.93 -58.59 4.62 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 115.429 1.64 . . . . 0.0 115.429 -175.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -75.1 -36.78 61.67 Favored 'General case' 0 CA--C 1.496 -1.127 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -175.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.76 -31.41 72.37 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 123.703 0.627 . . . . 0.0 109.346 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.79 -56.11 9.06 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.592 177.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 49.3 m95 -59.43 -42.05 90.97 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . 0.415 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.7 OUTLIER -52.43 -60.48 3.18 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.339 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -56.13 -47.7 77.65 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.506 -1.679 . . . . 0.0 111.159 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.66 -59.67 4.58 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 123.421 0.688 . . . . 0.0 112.81 -176.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 86.9 mt -54.51 -51.27 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 O-C-N 123.793 0.683 . . . . 0.0 111.839 -174.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . 0.406 ' OE1' ' HE2' ' B' ' 86' ' ' LYS . 49.1 mt-30 -62.66 -44.27 96.69 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.096 -174.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . 0.524 ' HA ' ' O ' ' B' ' 94' ' ' HIS 0.296 19.4 ptmt -81.62 -19.67 41.33 Favored 'General case' 0 C--O 1.21 -0.998 0 C-N-CA 119.256 -0.978 . . . . 0.0 113.447 179.627 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.37 -38.45 81.41 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.453 -0.779 . . . . 0.0 109.216 173.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -74.18 -32.67 63.18 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.601 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . 0.524 ' O ' ' HA ' ' B' ' 91' ' ' LYS . 58.1 m170 -140.05 103.04 4.53 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 174.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.481 ' HB2' ' HD3' ' B' ' 96' ' ' PRO . 1.5 mpt? -53.29 -50.78 80.67 Favored Pre-proline 0 N--CA 1.473 0.701 0 O-C-N 123.39 0.431 . . . . 0.0 110.885 -178.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.582 ' HD2' ' SD ' ' A' ' 51' ' ' MET . 11.4 Cg_endo -99.29 95.06 0.05 OUTLIER 'Trans proline' 0 N--CA 1.425 -2.513 0 C-N-CA 122.175 1.917 . . . . 0.0 110.057 169.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -110.38 132.27 21.6 Favored Pre-proline 0 C--N 1.307 -1.272 0 C-N-CA 120.511 -0.475 . . . . 0.0 111.506 -176.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.44 64.09 8.49 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.013 2.476 . . . . 0.0 110.667 174.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -72.02 88.79 1.09 Allowed 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.749 -176.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -1.099 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.618 179.152 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.384 0 CA-C-O 120.812 0.339 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.454 ' OD1' ' HA ' ' A' ' 70' ' ' THR . 25.0 m-20 -86.34 111.02 20.08 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-O 121.141 0.496 . . . . 0.0 109.769 -175.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -87.57 77.28 8.79 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.2 tp -118.85 142.49 47.68 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -176.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.599 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 38.2 p -72.67 142.9 48.26 Favored 'General case' 0 N--CA 1.427 -1.6 0 C-N-CA 119.223 -0.991 . . . . 0.0 108.864 176.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -71.58 -18.05 62.26 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 112.98 0.734 . . . . 0.0 112.98 -172.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -71.05 -36.52 72.34 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.599 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 6.8 mm100 -70.11 -39.89 75.22 Favored 'General case' 0 C--O 1.196 -1.743 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 177.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.44 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 32.0 mt -59.93 -39.11 79.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.039 176.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.88 -47.26 85.8 Favored 'General case' 0 C--O 1.246 0.914 0 C-N-CA 123.308 0.643 . . . . 0.0 111.064 176.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.424 ' OE1' ' HB3' ' A' ' 148' ' ' LYS . 32.3 tt0 -63.46 -42.09 98.61 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.801 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.535 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 14.9 m-30 -65.37 -34.72 78.97 Favored 'General case' 0 C--O 1.187 -2.212 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.085 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 97.3 mttt -57.03 -43.45 81.89 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.245 0.341 . . . . 0.0 110.89 174.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -59.68 -61.15 2.83 Favored 'General case' 0 C--O 1.258 1.509 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.576 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.64 -26.56 67.86 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.797 -177.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.535 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 30.9 t80 -61.37 -47.6 85.11 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 123.332 0.653 . . . . 0.0 110.503 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.1 m -75.28 -16.93 60.4 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.164 0.507 . . . . 0.0 110.977 178.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.34 -36.64 79.56 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 172.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -84.25 -41.79 16.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.025 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -80.74 99.14 8.07 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.453 ' HB2' ' HZ2' ' A' ' 21' ' ' LYS . 10.0 mtmp? -73.6 -1.68 19.8 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -172.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -116.75 -14.38 10.77 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 117.996 -1.482 . . . . 0.0 112.014 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.53 28.34 33.02 Favored Glycine 0 C--N 1.309 -0.929 0 C-N-CA 120.28 -0.962 . . . . 0.0 112.637 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -101.2 -17.44 16.62 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.197 0.523 . . . . 0.0 109.788 178.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.58 20.45 76.64 Favored Glycine 0 N--CA 1.437 -1.262 0 CA-C-N 115.537 -0.756 . . . . 0.0 114.733 176.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.6 p -132.04 128.69 38.82 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 171.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.7 mt -104.31 115.75 46.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.846 0 O-C-N 121.873 -0.517 . . . . 0.0 109.731 -174.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -83.61 173.35 11.48 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.043 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.1 p -61.87 -43.05 99.64 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 120.864 0.364 . . . . 0.0 111.022 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -64.91 -35.08 79.99 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.656 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.77 -45.35 68.23 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.083 177.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.9 mt -54.59 -55.72 26.47 Favored 'General case' 0 C--O 1.201 -1.477 0 O-C-N 124.133 0.895 . . . . 0.0 110.723 177.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.25 -31.69 77.96 Favored Glycine 0 CA--C 1.522 0.508 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.486 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.3 m -70.95 -48.77 51.62 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 117.285 0.542 . . . . 0.0 110.686 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.4 m -68.39 -35.11 69.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.637 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.238 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 64.5 mtt -65.82 -33.03 74.92 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.149 177.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -62.67 -41.94 99.35 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -68.23 -20.43 64.82 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.706 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.45 ' C ' ' HD2' ' B' ' 91' ' ' LYS . 4.3 mm? -101.0 13.85 33.87 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.048 0.452 . . . . 0.0 112.152 177.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.97 26.98 61.15 Favored Glycine 0 C--O 1.241 0.575 0 N-CA-C 114.564 0.586 . . . . 0.0 114.564 173.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -127.07 124.41 39.19 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -119.27 78.01 18.22 Favored Pre-proline 0 C--N 1.298 -1.639 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -89.31 160.09 5.59 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 122.29 1.993 . . . . 0.0 112.1 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 39.6 p -80.85 159.98 24.9 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.68 -26.59 68.45 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 120.687 0.28 . . . . 0.0 110.656 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.68 -46.92 85.95 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.105 0.479 . . . . 0.0 110.037 175.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -66.6 -35.02 79.18 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.331 178.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.444 ' O ' HG13 ' A' ' 52' ' ' ILE . 97.1 mt -66.01 -49.87 66.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.983 177.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -58.43 -43.68 88.81 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 122.959 0.503 . . . . 0.0 110.789 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -65.32 -40.77 94.14 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.083 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.8 tpt -62.27 -42.34 99.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.426 0.631 . . . . 0.0 109.582 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 48' ' ' LEU . 79.5 mt -62.21 -48.98 85.88 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.922 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.913 177.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -52.5 -37.09 56.63 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -174.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -66.43 -28.33 68.52 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.09 -1.044 . . . . 0.0 111.637 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.41 HG13 ' HB2' ' A' ' 71' ' ' MET . 7.8 m -101.58 -20.84 5.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.565 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -72.59 111.81 8.09 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 123.904 0.882 . . . . 0.0 111.182 -174.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.87 -16.05 37.22 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.604 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -98.19 -12.42 21.71 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 -177.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.11 31.91 62.42 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -173.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.3 p-10 -98.31 -5.42 32.97 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -172.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.58 23.55 39.2 Favored Glycine 0 N--CA 1.44 -1.05 0 C-N-CA 120.087 -1.054 . . . . 0.0 112.458 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.24 139.95 30.46 Favored 'General case' 0 C--O 1.253 1.279 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 178.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 65.2 mt -92.66 111.75 24.95 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -85.41 166.11 16.66 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.443 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 70.7 t80 -56.17 -53.63 61.47 Favored Pre-proline 0 CA--C 1.554 1.127 0 O-C-N 123.425 0.453 . . . . 0.0 112.114 179.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.443 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -51.94 -37.35 66.99 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.927 2.418 . . . . 0.0 112.383 175.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -74.55 -33.55 62.75 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.458 0.647 . . . . 0.0 110.3 -177.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -68.21 -36.8 80.1 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 87.3 mt -61.73 -47.04 87.05 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.396 175.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.454 ' HA ' ' OD1' ' A' ' 2' ' ' ASP . 55.8 m -56.24 -47.02 79.33 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 123.764 0.665 . . . . 0.0 110.827 177.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.41 ' HB2' HG13 ' A' ' 55' ' ' VAL . 28.3 ttp -57.58 -42.25 82.76 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 123.205 0.602 . . . . 0.0 111.551 179.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 25.1 mmt -75.28 -44.92 43.11 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.434 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.26 77.48 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.927 0.394 . . . . 0.0 110.227 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -63.87 -46.49 84.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.582 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -62.24 -51.74 66.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.394 -175.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.0 ttm -56.05 -43.32 77.77 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 125.169 1.388 . . . . 0.0 112.528 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 50.3 tttp -89.15 -24.82 22.11 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.895 -174.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -80.77 -58.8 2.93 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-O 121.855 0.836 . . . . 0.0 112.049 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.2 t -101.49 88.71 3.51 Favored 'General case' 0 C--N 1.245 -3.977 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.693 -177.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -117.72 0.41 12.0 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.638 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.9 m -77.89 35.82 0.21 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 123.71 0.804 . . . . 0.0 112.614 -173.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 61.47 16.48 7.58 Favored 'General case' 0 C--O 1.209 -1.063 0 C-N-CA 123.916 0.886 . . . . 0.0 110.937 -177.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -70.25 -56.39 6.89 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 116.891 -0.14 . . . . 0.0 111.053 -172.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -63.61 -28.75 70.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.806 0.813 . . . . 0.0 109.878 178.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.5 mm -70.96 -52.74 25.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-N 114.464 -1.243 . . . . 0.0 109.646 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 35.4 ttm180 -71.31 -35.83 71.39 Favored 'General case' 0 C--O 1.204 -1.304 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.13 -176.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -58.26 -37.59 75.24 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 123.257 0.348 . . . . 0.0 111.502 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -70.25 -39.23 75.15 Favored 'General case' 0 C--O 1.211 -0.923 0 O-C-N 123.484 0.49 . . . . 0.0 110.849 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -71.52 -45.39 62.52 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.457 0.646 . . . . 0.0 109.899 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -64.3 -28.3 69.62 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 125.824 1.65 . . . . 0.0 111.974 -176.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 88' ' ' ALA . 8.4 p -77.81 -22.61 13.9 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.877 -179.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -89.3 -56.81 3.12 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 174.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -91.4 80.95 5.45 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 122.136 0.97 . . . . 0.0 109.159 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.497 ' HD2' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -78.53 -30.17 46.88 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.51 -1.223 . . . . 0.0 113.572 -175.688 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.8 -13.49 59.38 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.516 0.674 . . . . 0.0 110.612 -178.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.62 76.16 0.8 Allowed Glycine 0 N--CA 1.438 -1.202 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.01 177.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -110.72 -19.25 12.92 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.199 0.523 . . . . 0.0 109.854 178.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.62 0.98 87.78 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.91 176.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -141.31 145.44 35.48 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -178.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.8 mt -105.5 113.54 42.68 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.6 m -96.46 156.58 16.28 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.88 -39.95 96.04 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 117.748 0.249 . . . . 0.0 111.04 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.51 -44.44 96.01 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 123.399 0.437 . . . . 0.0 110.569 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -65.39 -49.74 68.15 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.277 177.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.441 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.3 tm? -60.79 -40.57 93.14 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 115.305 -0.862 . . . . 0.0 108.746 -174.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -59.47 -47.14 86.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 176.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -55.49 -52.73 62.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.725 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.699 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.8 p -66.2 -37.63 80.16 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.553 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.358 -177.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.441 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.9 mmt -60.69 -41.32 94.94 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.7 m -58.82 -41.31 86.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 175.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -74.49 -24.02 58.95 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.443 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 84.1 mt -87.61 -19.62 27.53 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.097 0.475 . . . . 0.0 110.098 -178.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 83.19 35.05 19.09 Favored Glycine 0 N--CA 1.43 -1.745 0 C-N-CA 120.892 -0.671 . . . . 0.0 111.543 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -98.83 132.95 43.79 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -84.5 46.22 1.21 Allowed 'General case' 0 C--N 1.292 -1.935 0 C-N-CA 123.473 0.709 . . . . 0.0 110.951 -176.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 38.2 mt -86.2 129.52 34.82 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.7 p -79.01 168.44 19.68 Favored 'General case' 0 C--N 1.297 -1.704 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.479 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.445 ' O ' HG23 ' A' ' 121' ' ' VAL . 25.0 t70 -61.51 -50.73 71.54 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -176.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -60.38 -32.87 71.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.486 0.66 . . . . 0.0 109.719 178.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -71.52 -43.42 66.49 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.873 -178.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 118' ' ' ASP . 17.5 m -68.98 -32.55 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 177.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -67.23 -45.57 76.35 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.529 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -72.06 -32.59 67.22 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.687 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.5 tpp -53.28 -49.22 67.4 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 172.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.0 mm -67.15 -48.33 79.01 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.208 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.531 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -57.67 -33.75 68.67 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.702 0.801 . . . . 0.0 112.259 -175.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -82.76 -23.82 33.78 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.163 0.506 . . . . 0.0 111.189 -178.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -87.98 -24.05 23.65 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.668 0.746 . . . . 0.0 109.522 177.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.485 ' OD2' ' HA2' ' A' ' 132' ' ' GLY . 5.0 t70 -69.96 99.72 1.47 Allowed 'General case' 0 C--N 1.309 -1.152 0 C-N-CA 125.825 1.65 . . . . 0.0 109.763 175.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.6 mt -82.33 -47.76 18.73 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -73.84 -10.68 59.91 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 121.203 0.525 . . . . 0.0 110.997 -176.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.485 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 72.56 52.21 10.6 Favored Glycine 0 N--CA 1.437 -1.286 0 N-CA-C 110.282 -1.127 . . . . 0.0 110.282 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -106.46 -17.37 14.29 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -177.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.64 -9.37 52.3 Favored Glycine 0 N--CA 1.437 -1.251 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.245 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -133.3 137.3 45.92 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 -178.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 1.3 p -88.14 116.92 30.87 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 CA-C-O 121.589 0.709 . . . . 0.0 110.469 177.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -84.5 159.58 20.7 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 114.832 -1.077 . . . . 0.0 109.819 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.488 ' O ' HG11 ' A' ' 142' ' ' VAL . 77.0 t80 -54.85 -46.74 74.71 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 123.858 0.863 . . . . 0.0 111.328 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.2 -22.34 65.84 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -87.77 -43.3 11.97 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.57 -35.47 81.09 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.941 -178.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.488 HG11 ' O ' ' A' ' 138' ' ' TYR . 32.6 m -58.38 -35.89 56.07 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.924 0 CA-C-O 120.933 0.397 . . . . 0.0 110.908 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -75.43 -21.05 58.48 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.41 -178.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 92.4 mmm -76.98 -35.42 57.2 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 90.6 mmm -73.6 -23.87 59.97 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 113.455 -1.702 . . . . 0.0 110.362 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 22.6 m -88.22 -6.45 57.81 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 121.263 0.554 . . . . 0.0 110.346 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -81.57 45.36 0.87 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.373 0.606 . . . . 0.0 111.905 -176.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.487 ' HA ' ' NZ ' ' B' ' 82' ' ' LYS . 7.7 mtpm? . . . . . 0 C--N 1.304 -1.405 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -74.99 -8.31 19.96 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 122.409 2.073 . . . . 0.0 111.045 174.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.6 163.27 14.18 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.376 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -119.56 131.36 55.51 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.5 m -58.11 -39.83 79.65 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 122.486 0.314 . . . . 0.0 110.856 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -73.58 -22.14 60.14 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -76.93 -35.74 57.1 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 178.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -79.67 -23.22 42.63 Favored 'General case' 0 C--O 1.196 -1.713 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.899 174.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . 0.514 ' O ' ' HG3' ' B' ' 86' ' ' LYS . 87.4 tttt -60.63 -33.96 73.54 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 173.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -59.8 -50.93 71.9 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 176.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.46 -41.81 98.62 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 113.468 -1.696 . . . . 0.0 111.303 177.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 74.1 m95 -58.02 -36.43 72.69 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 177.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . 0.514 ' HG3' ' O ' ' B' ' 82' ' ' LYS . 89.1 mttt -52.6 -34.88 52.84 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.483 0.658 . . . . 0.0 110.171 177.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -85.02 -54.28 4.75 Favored 'General case' 0 C--O 1.205 -1.283 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.891 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.0 -51.63 51.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.904 0.882 . . . . 0.0 112.748 -176.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 50.4 mm -61.32 -53.35 49.9 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.427 0 CA-C-O 121.543 0.687 . . . . 0.0 109.604 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -69.31 -32.43 71.56 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.624 -1.171 . . . . 0.0 112.173 -171.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . 0.45 ' HD2' ' C ' ' A' ' 39' ' ' LEU . 22.3 tptm -67.71 -39.44 84.35 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.373 0.669 . . . . 0.0 109.699 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.42 -51.45 7.83 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.79 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -61.98 -29.46 70.27 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.953 -177.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 12.0 t60 63.81 77.84 0.31 Allowed 'General case' 0 C--N 1.344 0.349 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 83.2 mtp -101.52 120.15 55.39 Favored Pre-proline 0 C--N 1.301 -1.529 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.469 -173.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -70.11 -19.66 34.15 Favored 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 122.686 2.257 . . . . 0.0 110.401 173.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -99.75 116.23 64.95 Favored Pre-proline 0 N--CA 1.436 -1.148 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.353 175.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -58.0 116.46 3.25 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 122.731 2.287 . . . . 0.0 110.252 178.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -81.09 113.62 19.39 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.155 -172.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.421 -1.875 0 CA-C-N 114.328 -1.306 . . . . 0.0 107.712 177.942 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.304 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 22.0 t70 67.69 -73.18 0.08 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.141 0.976 . . . . 0.0 112.978 177.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -82.93 117.31 22.68 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 -177.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.44 ' HB3' HD11 ' A' ' 9' ' ' ILE . 13.3 tp -103.76 160.42 14.79 Favored 'General case' 0 N--CA 1.423 -1.811 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -177.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.7 p -90.64 157.02 17.7 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 122.848 0.459 . . . . 0.0 111.372 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -51.29 -49.84 60.48 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 -174.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -40.67 95.95 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -176.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -67.27 -44.05 80.3 Favored 'General case' 0 C--O 1.211 -0.931 0 O-C-N 123.52 0.513 . . . . 0.0 110.015 176.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.511 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 78.5 mt -62.52 -42.4 95.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.614 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.41 -35.76 81.12 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-O 121.555 0.693 . . . . 0.0 110.205 178.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -63.27 -49.99 71.92 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.923 178.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.437 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 42.1 m-85 -71.12 -24.0 62.2 Favored 'General case' 0 C--O 1.177 -2.759 0 CA-C-N 114.88 -1.054 . . . . 0.0 112.459 -179.187 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.1 mttt -62.95 -40.92 99.12 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 119.056 0.843 . . . . 0.0 110.023 174.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -58.81 -56.38 22.95 Favored 'General case' 0 C--O 1.25 1.1 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.119 178.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.448 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -72.61 -23.76 60.98 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.281 -176.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.437 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 47.5 t80 -64.84 -44.34 90.13 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 177.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.8 t -75.76 -16.94 60.06 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.864 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.448 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 38.6 tp -72.18 -41.51 66.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.054 174.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.448 ' CE1' ' HA ' ' B' ' 100' ' ' ALA . 21.7 m-85 -80.41 -40.45 26.41 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.223 178.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -72.44 99.05 2.38 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -83.63 1.73 40.89 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -174.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.571 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 10.4 m-20 -105.68 -13.9 15.42 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.533 179.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.92 34.52 55.77 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.85 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.571 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 2.6 p30 -113.29 -16.88 12.44 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -178.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.73 33.6 33.6 Favored Glycine 0 C--N 1.311 -0.809 0 N-CA-C 114.999 0.76 . . . . 0.0 114.999 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.7 p -149.28 129.04 13.27 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 171.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 60.0 mt -99.18 120.19 48.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-O 121.298 0.571 . . . . 0.0 112.074 -170.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.0 p -93.45 175.18 6.85 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.993 178.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 46.2 p -67.58 -25.52 65.82 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.493 0.664 . . . . 0.0 109.734 176.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -57.89 -57.05 14.48 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.014 175.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -65.11 -40.73 94.94 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.373 -177.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.7 -52.55 64.99 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 123.488 0.492 . . . . 0.0 110.547 175.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.79 -31.05 78.59 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.312 -0.947 . . . . 0.0 112.798 -178.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.0 m -72.74 -43.22 63.19 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 117.467 0.634 . . . . 0.0 111.226 178.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.601 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 35.0 m -67.43 -36.06 75.31 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.422 176.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.471 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 66.2 mtt -67.48 -35.09 78.49 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.187 177.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -61.1 -38.72 87.28 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.3 t -72.02 -28.3 63.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.809 177.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 80.4 mt -78.91 -20.15 50.09 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.881 0.372 . . . . 0.0 110.505 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.37 32.46 7.36 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 121.373 -0.442 . . . . 0.0 112.27 179.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.411 ' C ' HD21 ' A' ' 42' ' ' ASN . 36.1 tt0 -145.18 139.53 27.3 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.411 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -126.25 80.03 69.21 Favored Pre-proline 0 C--N 1.3 -1.573 0 O-C-N 121.773 -0.579 . . . . 0.0 112.403 -179.058 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.471 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 21.9 Cg_exo -69.82 149.43 66.53 Favored 'Trans proline' 0 C--O 1.242 0.705 0 C-N-CA 121.82 1.68 . . . . 0.0 109.447 173.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.1 p -78.95 162.53 25.92 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -174.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -44.49 -56.44 4.29 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 126.162 1.785 . . . . 0.0 113.657 -174.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.95 -34.52 76.74 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -175.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -60.78 -45.47 94.23 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.431 ' O ' HG13 ' A' ' 52' ' ' ILE . 96.7 mt -60.83 -43.19 98.59 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.991 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -73.55 -31.78 63.84 Favored 'General case' 0 N--CA 1.44 -0.927 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.448 -178.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.487 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 31.2 t70 -67.27 -40.06 86.12 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 119.719 -0.792 . . . . 0.0 109.577 175.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.462 ' HE3' ' HA ' ' A' ' 51' ' ' MET . 2.8 tpt -59.37 -37.2 77.3 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.368 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 48' ' ' LEU . 45.5 mt -66.41 -50.93 63.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.725 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.772 174.37 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -59.81 -23.12 63.07 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 124.016 0.926 . . . . 0.0 112.724 -173.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 17.0 mm-40 -62.0 -36.94 83.02 Favored 'General case' 0 N--CA 1.396 -3.143 0 C-N-CA 124.479 1.112 . . . . 0.0 111.164 175.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.529 HG12 ' SD ' ' A' ' 71' ' ' MET . 28.9 m -109.02 -14.41 10.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.761 0.315 . . . . 0.0 111.383 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -72.61 114.14 10.42 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.72 -18.91 30.02 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.964 -177.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -97.12 -12.37 23.21 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.57 37.06 88.03 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 -174.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.0 p-10 -101.49 -7.65 22.65 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.36 18.37 28.75 Favored Glycine 0 N--CA 1.436 -1.324 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.937 173.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 p -143.64 142.48 31.04 Favored 'General case' 0 C--O 1.253 1.276 0 CA-C-N 116.731 0.265 . . . . 0.0 110.436 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.9 mt -92.19 108.89 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.64 169.7 15.96 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.431 ' CE2' HD13 ' A' ' 69' ' ' LEU . 52.6 t80 -58.59 -55.88 41.32 Favored Pre-proline 0 CA--C 1.554 1.11 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -176.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.01 -37.08 78.3 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.498 2.132 . . . . 0.0 112.117 176.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -70.25 -39.84 74.79 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.009 0.433 . . . . 0.0 110.433 -178.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -66.08 -39.85 90.36 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.431 HD13 ' CE2' ' A' ' 65' ' ' PHE . 83.4 mt -65.35 -45.24 84.95 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.354 177.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 89.1 m -56.96 -44.71 82.87 Favored 'General case' 0 C--O 1.239 0.535 0 O-C-N 123.466 0.479 . . . . 0.0 109.976 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.529 ' SD ' HG12 ' A' ' 55' ' ' VAL . 32.5 ttp -58.9 -49.13 78.95 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.879 177.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.5 mmt -62.52 -43.84 97.84 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.73 -24.69 66.97 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.087 0.47 . . . . 0.0 111.476 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.9 mtp180 -82.77 -41.54 19.05 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.386 0.613 . . . . 0.0 109.497 175.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 81' ' ' SER . 59.4 tttp -67.99 -28.71 67.67 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.705 -1.134 . . . . 0.0 111.623 -172.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 73.8 mtm -96.16 6.09 49.6 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -133.13 -48.55 0.85 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -178.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -75.11 -77.99 0.11 Allowed 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 122.041 0.924 . . . . 0.0 112.299 -173.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.1 m -147.31 170.91 16.31 Favored 'General case' 0 C--N 1.249 -3.785 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.0 t70 72.89 33.66 1.21 Allowed 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 123.014 1.387 . . . . 0.0 109.147 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.52 ' O ' HG12 ' A' ' 85' ' ' ILE . 22.9 t -120.0 -65.42 1.16 Allowed 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.369 -1.287 . . . . 0.0 109.602 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -63.12 -35.99 82.11 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.526 0.679 . . . . 0.0 110.07 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.542 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 1.6 mp0 -70.23 -33.25 71.43 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.717 178.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -64.02 -46.66 83.51 Favored 'General case' 0 CA--C 1.492 -1.266 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 81' ' ' SER . 6.9 mm -64.73 -35.77 75.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 114.759 -1.11 . . . . 0.0 109.311 -176.315 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -64.14 -49.76 70.89 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.444 175.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 83' ' ' GLU . 40.4 mm-40 -64.41 -36.15 83.22 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.849 0.356 . . . . 0.0 111.83 -176.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.2 -28.06 67.77 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.583 177.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -80.51 -49.55 11.22 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.594 0.712 . . . . 0.0 109.097 176.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -53.94 -30.91 48.58 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 126.379 1.872 . . . . 0.0 112.681 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.447 HG23 ' O ' ' B' ' 92' ' ' ALA . 14.2 p -70.8 -29.39 37.51 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.641 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -86.24 -49.47 7.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 176.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -88.44 79.33 7.7 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.975 179.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' A' ' 91' ' ' VAL . 70.7 mmtt -75.53 -30.55 59.81 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.621 -177.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -85.37 -12.48 52.07 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -177.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.81 51.6 6.29 Favored Glycine 0 CA--C 1.502 -0.733 0 C-N-CA 120.77 -0.729 . . . . 0.0 111.678 177.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.42 ' N ' HD21 ' A' ' 97' ' ' ASN . 0.9 OUTLIER -90.31 -17.96 26.43 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 123.073 0.549 . . . . 0.0 110.053 -179.423 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.15 9.56 79.89 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.456 178.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 39.7 p90 -157.28 156.96 33.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.433 ' HB ' HG11 ' A' ' 136' ' ' VAL . 4.0 mt -105.21 134.88 45.44 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.0 t -107.59 151.01 26.19 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 177.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.12 -55.87 29.5 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -175.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.0 -26.94 68.5 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.137 0.494 . . . . 0.0 110.965 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.95 -40.49 65.35 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.515 177.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.4 tt -63.56 -39.43 94.38 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.474 ' HD2' ' O ' ' A' ' 106' ' ' ARG . 4.2 tmm_? -66.76 -38.49 86.7 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -59.73 -48.75 80.45 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.048 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.597 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.8 p -65.02 -33.42 63.62 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.298 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.099 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.483 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.7 mmt -59.72 -45.51 91.96 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-O 120.751 0.31 . . . . 0.0 111.569 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 23.7 m -64.69 -29.75 70.75 Favored 'General case' 0 CA--C 1.563 1.459 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.214 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.73 -24.35 41.68 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.105 0.479 . . . . 0.0 111.091 177.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 77.3 mt -89.17 -19.95 24.84 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.722 0.409 . . . . 0.0 111.01 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.27 24.97 9.79 Favored Glycine 0 C--N 1.308 -1.014 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.905 -178.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -111.1 154.44 24.27 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 121.412 0.625 . . . . 0.0 109.5 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -124.09 104.68 9.01 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.207 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 61.7 mt -124.52 151.75 44.27 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 35.7 p -86.85 169.63 12.38 Favored 'General case' 0 C--N 1.29 -2.012 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -66.18 -35.13 79.66 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.96 -43.69 94.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.047 175.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -65.57 -53.65 38.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.885 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.437 ' O ' HG12 ' A' ' 125' ' ' ILE . 23.1 m -65.36 -36.47 77.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.566 -176.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -69.08 -34.3 74.91 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 120.893 0.378 . . . . 0.0 110.441 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.41 -40.51 77.25 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.2 mtt -56.62 -50.99 70.37 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.701 176.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.2 mm -58.02 -45.52 88.07 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 O-C-N 123.919 0.762 . . . . 0.0 109.484 178.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.6 ttp-105 -58.92 -31.74 68.93 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -176.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 128' ' ' ALA . 0.4 OUTLIER -79.4 -32.82 43.07 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 117.974 -1.49 . . . . 0.0 109.931 178.357 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.438 ' N ' ' HG3' ' A' ' 127' ' ' GLU . . . -84.75 -24.76 28.67 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.582 -175.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.413 ' OD2' ' HA2' ' A' ' 132' ' ' GLY . 18.9 t70 -73.51 89.53 1.69 Allowed 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 124.117 0.967 . . . . 0.0 108.584 175.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 84.7 mt -82.84 -35.85 12.69 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.926 -174.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -81.31 -9.29 59.78 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.561 0.696 . . . . 0.0 111.296 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.413 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 73.08 49.57 15.82 Favored Glycine 0 CA--C 1.499 -0.908 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.697 175.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -115.47 -16.46 11.38 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-O 121.385 0.612 . . . . 0.0 110.942 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.0 5.35 60.97 Favored Glycine 0 C--N 1.304 -1.205 0 N-CA-C 111.097 -0.801 . . . . 0.0 111.097 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -131.73 125.21 31.43 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.433 HG11 ' HB ' ' A' ' 100' ' ' ILE . 1.2 p -94.58 111.28 25.14 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.833 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.357 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -85.85 168.98 13.75 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.431 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.569 ' O ' HG11 ' A' ' 142' ' ' VAL . 92.5 t80 -57.18 -45.77 83.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.103 -176.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.467 ' O ' HG23 ' A' ' 142' ' ' VAL . 10.8 pt-20 -61.91 -27.95 69.18 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.31 0.576 . . . . 0.0 111.678 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -82.39 -41.02 20.47 Favored 'General case' 0 N--CA 1.414 -2.259 0 CA-C-O 122.126 0.965 . . . . 0.0 108.458 -177.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -60.12 -44.65 94.72 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.74 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.569 HG11 ' O ' ' A' ' 138' ' ' TYR . 19.7 m -56.33 -33.85 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 CA-C-O 121.126 0.489 . . . . 0.0 112.193 -177.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -80.09 -50.9 9.68 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.521 -174.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -24.09 63.09 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.408 -176.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 25.9 ttt -79.09 -37.71 38.1 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.646 -0.422 . . . . 0.0 112.004 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 7.6 t -83.89 -18.06 38.7 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 119.926 -0.709 . . . . 0.0 110.014 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -118.0 74.4 0.94 Allowed 'General case' 0 N--CA 1.432 -1.349 0 CA-C-O 121.358 0.599 . . . . 0.0 109.553 177.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm . . . . . 0 N--CA 1.419 -2.005 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 178.821 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 N--CA 1.44 -0.934 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -62.54 -55.74 0.83 Allowed 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.091 1.861 . . . . 0.0 110.245 176.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . 52.89 36.02 20.58 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 123.922 0.889 . . . . 0.0 111.367 175.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -72.0 -20.21 61.75 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.9 -173.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -93.52 -3.13 53.42 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 65.58 -64.68 0.18 Allowed 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 115.316 1.598 . . . . 0.0 115.316 176.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -62.71 -21.33 65.69 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 119.074 0.852 . . . . 0.0 112.344 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -64.53 -30.26 71.29 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.321 0.581 . . . . 0.0 111.06 176.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.27 -35.82 74.0 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -71.41 -22.65 61.83 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.11 177.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.57 -44.45 90.67 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 52.7 m95 -71.06 -36.06 72.16 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.092 175.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -57.19 -54.08 50.84 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 178.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -59.4 -46.14 89.53 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.573 -1.649 . . . . 0.0 111.104 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.2 -55.84 29.77 Favored 'General case' 0 CA--C 1.503 -0.837 0 O-C-N 123.283 0.364 . . . . 0.0 111.122 -179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 50.5 mm -60.04 -47.3 92.37 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.711 0 O-C-N 123.524 0.515 . . . . 0.0 110.227 -178.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -54.77 -51.98 64.0 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 123.239 0.616 . . . . 0.0 112.141 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 19.8 tptm -69.84 -35.89 75.11 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.097 0.475 . . . . 0.0 111.572 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . 0.447 ' O ' HG23 ' A' ' 91' ' ' VAL . . . -77.82 -34.16 52.13 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.237 -177.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? -52.83 -48.81 66.73 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.535 1.134 . . . . 0.0 109.362 -178.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 46.41 69.29 0.49 Allowed 'General case' 0 N--CA 1.486 1.334 0 O-C-N 124.42 1.075 . . . . 0.0 113.049 171.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 67.0 mtt -150.36 156.6 37.09 Favored Pre-proline 0 C--N 1.31 -1.11 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -178.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -75.12 -3.73 14.34 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.438 2.092 . . . . 0.0 112.776 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -75.1 124.33 89.33 Favored Pre-proline 0 C--N 1.318 -0.783 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.129 178.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.62 119.42 6.66 Favored 'Trans proline' 0 C--O 1.251 1.133 0 C-N-CA 123.18 2.587 . . . . 0.0 113.234 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -119.72 163.09 17.95 Favored 'General case' 0 N--CA 1.424 -1.757 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . 0.448 ' HA ' ' CE1' ' A' ' 19' ' ' PHE . . . . . . . . 0 N--CA 1.426 -1.643 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 174.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.362 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -138.96 81.68 1.86 Allowed 'General case' 0 C--N 1.297 -1.715 0 CA-C-O 122.527 1.155 . . . . 0.0 109.788 176.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -101.36 96.94 7.5 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.474 ' HG ' ' HB2' ' A' ' 8' ' ' GLN . 9.1 tp -133.3 143.55 49.11 Favored 'General case' 0 N--CA 1.426 -1.635 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -174.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.451 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 71.4 p -84.44 159.2 20.83 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 119.519 -0.872 . . . . 0.0 109.591 177.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.61 -30.76 71.59 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 111.946 0.351 . . . . 0.0 111.946 -175.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -57.54 -46.11 84.28 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 177.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.474 ' HB2' ' HG ' ' A' ' 4' ' ' LEU . 60.3 mm-40 -65.75 -51.72 56.92 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.408 -179.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.428 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 78.8 mt -57.83 -36.99 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.73 -176.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 13' ' ' LYS . . . -67.26 -40.84 86.26 Favored 'General case' 0 C--O 1.254 1.29 0 CA-C-O 121.594 0.711 . . . . 0.0 110.6 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -64.64 -40.81 96.1 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.375 -0.83 . . . . 0.0 108.995 176.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -60.8 -38.16 84.42 Favored 'General case' 0 C--O 1.162 -3.516 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.307 174.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 10' ' ' ALA . 32.8 mmtp -52.46 -56.47 14.85 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-N 118.318 0.508 . . . . 0.0 111.155 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -64.85 -51.27 62.99 Favored 'General case' 0 C--O 1.25 1.113 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.18 -37.55 87.87 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.996 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -59.8 -42.63 93.85 Favored 'General case' 0 C--O 1.206 -1.205 0 C-N-CA 123.489 0.716 . . . . 0.0 110.272 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.8 m -68.32 -23.69 64.75 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 123.516 0.51 . . . . 0.0 110.742 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.7 tt -73.27 -31.25 63.96 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 121.365 0.602 . . . . 0.0 109.441 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -87.71 -33.04 18.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.475 179.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -79.52 90.61 5.1 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -64.47 -47.06 80.39 Favored 'General case' 0 N--CA 1.428 -1.546 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 -170.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.429 ' OD2' ' HB3' ' A' ' 24' ' ' ASP . 6.7 p-10 -83.2 -13.23 55.84 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.161 -178.112 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.64 58.5 6.35 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 116.008 -0.542 . . . . 0.0 113.145 177.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.429 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 4.8 p-10 -113.62 -15.91 12.43 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 120.991 0.424 . . . . 0.0 110.064 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.33 10.49 38.76 Favored Glycine 0 N--CA 1.43 -1.732 0 CA-C-N 115.962 -0.563 . . . . 0.0 113.955 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 71.2 p -136.75 160.53 38.58 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 118.02 0.91 . . . . 0.0 108.987 175.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.0 mt -120.96 120.4 62.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.152 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.6 p -95.13 175.41 6.63 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.616 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -59.2 -42.75 91.66 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 123.605 0.762 . . . . 0.0 110.606 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -58.73 -44.76 90.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.888 178.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -67.48 -38.69 84.76 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.772 -179.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.23 -46.71 89.27 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.146 176.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.4 -25.19 75.71 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.443 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.9 m -66.71 -54.55 21.77 Favored 'General case' 0 C--O 1.251 1.162 0 CA-C-O 121.31 0.576 . . . . 0.0 109.633 176.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 28.2 m -67.34 -36.13 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.145 -178.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 49.7 mtt -66.48 -44.4 82.79 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 177.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -59.46 -36.38 75.86 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.0 t -67.62 -14.0 62.56 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.005 179.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 59.6 mt -103.2 -11.57 17.92 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.327 177.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.09 -7.07 32.7 Favored Glycine 0 C--N 1.311 -0.851 0 C-N-CA 120.091 -1.052 . . . . 0.0 114.122 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.459 ' NE2' ' HB3' ' B' ' 96' ' ' PRO . 0.0 OUTLIER -107.56 131.3 54.5 Favored 'General case' 0 CA--C 1.483 -1.633 0 CA-C-N 118.013 0.907 . . . . 0.0 110.724 177.739 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.34 3.5 p30 -135.0 71.69 68.9 Favored Pre-proline 0 C--N 1.284 -2.28 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 173.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.87 157.19 25.11 Favored 'Trans proline' 0 C--N 1.357 1.016 0 C-N-CA 123.276 2.651 . . . . 0.0 111.472 173.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.5 p -78.17 165.18 24.26 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.425 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.84 -40.83 70.02 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 123.541 0.736 . . . . 0.0 112.04 -179.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.68 -43.75 93.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.188 0.518 . . . . 0.0 110.958 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -64.16 -42.66 96.65 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.544 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 87.7 mt -70.41 -38.59 74.64 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.306 -179.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -64.26 -40.49 96.09 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 123.151 0.58 . . . . 0.0 109.603 177.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.59 -35.56 78.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.76 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.51 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 66.5 mmm -74.38 -33.62 63.1 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.822 177.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.5 mt -66.97 -40.81 86.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 121.371 0.605 . . . . 0.0 109.481 175.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -63.66 -12.46 34.09 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.254 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.51 ' HB2' ' O ' ' A' ' 51' ' ' MET . 12.2 mm-40 -67.21 -23.54 65.75 Favored 'General case' 0 N--CA 1.394 -3.268 0 C-N-CA 123.742 0.817 . . . . 0.0 111.354 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.524 ' CG1' ' HB2' ' A' ' 71' ' ' MET . 17.4 m -119.58 -19.94 5.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.973 174.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -78.46 82.28 4.74 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.771 0.796 . . . . 0.0 111.843 -173.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.92 -21.81 26.06 Favored 'General case' 0 C--N 1.299 -1.621 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.434 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -81.78 -11.97 58.76 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.34 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.77 12.54 84.42 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 115.41 0.924 . . . . 0.0 115.41 173.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -80.48 -14.29 58.39 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.962 1.381 . . . . 0.0 110.395 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 79.75 20.34 68.62 Favored Glycine 0 N--CA 1.437 -1.279 0 CA-C-N 115.843 -0.617 . . . . 0.0 113.432 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.97 148.19 39.95 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.2 mt -92.26 116.17 32.82 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 108.758 -0.831 . . . . 0.0 108.758 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.423 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 7.1 t70 -87.14 172.53 9.87 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 174.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.432 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 46.7 t80 -57.13 -51.65 80.07 Favored Pre-proline 0 CA--C 1.555 1.168 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -175.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 8.7 Cg_endo -51.58 -42.48 55.81 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 122.973 2.448 . . . . 0.0 112.6 175.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.85 -39.63 87.66 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.632 0.729 . . . . 0.0 110.067 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -66.38 -40.66 89.84 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.598 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 78.0 mt -63.73 -37.78 88.66 Favored 'General case' 0 C--O 1.206 -1.196 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.987 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.443 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 86.5 m -59.22 -50.88 72.32 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 123.493 0.496 . . . . 0.0 110.912 178.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.524 ' HB2' ' CG1' ' A' ' 55' ' ' VAL . 34.0 ttp -66.03 -36.65 83.82 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.053 0.454 . . . . 0.0 111.84 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.5 mmt -82.22 -24.87 34.64 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.786 -0.766 . . . . 0.0 112.334 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.71 -29.89 67.39 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 173.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.718 ' HA ' ' O ' ' A' ' 78' ' ' ASP . 99.8 mtt180 -66.24 -29.86 70.19 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.731 0.777 . . . . 0.0 109.529 174.034 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -81.94 -12.14 58.53 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.937 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.9 ttm -104.34 -85.99 0.46 Allowed 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.484 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -141.51 15.47 2.18 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -173.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.718 ' O ' ' HA ' ' A' ' 74' ' ' ARG . 23.1 t70 -127.96 162.23 27.27 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.2 m -152.44 157.65 41.49 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 176.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -101.98 -55.01 2.58 Favored 'General case' 0 CA--C 1.499 -0.988 0 CA-C-N 118.772 0.715 . . . . 0.0 110.398 -178.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.8 m -121.22 -165.78 1.27 Allowed 'General case' 0 N--CA 1.412 -2.355 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.3 -178.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 82' ' ' GLU . 0.2 OUTLIER -100.34 -1.07 37.07 Favored 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 177.356 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.596 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 44.0 mt-10 -62.84 -58.47 7.29 Favored 'General case' 0 CA--C 1.489 -1.377 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.943 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -49.6 -45.36 47.94 Favored 'General case' 0 C--O 1.251 1.156 0 C-N-CA 124.817 1.247 . . . . 0.0 110.376 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 40.0 mm -66.75 -50.73 63.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 114.416 -1.265 . . . . 0.0 110.426 -177.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -70.66 -27.68 64.22 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.138 -177.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 51.4 mt-10 -60.08 -44.9 94.44 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 175.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.34 -38.11 81.17 Favored 'General case' 0 C--O 1.21 -1.008 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.831 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.76 -43.6 83.62 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.404 0.621 . . . . 0.0 110.139 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 -66.23 -26.76 67.52 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 124.739 1.216 . . . . 0.0 111.7 -176.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.0 p -83.76 -19.76 9.39 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 C-N-CA 120.308 -0.557 . . . . 0.0 111.287 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -91.3 -49.78 6.17 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 122.037 -0.414 . . . . 0.0 110.012 177.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -84.42 107.38 16.65 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 177.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -73.28 -26.62 61.16 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.342 -172.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -103.81 -14.18 16.14 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.529 0.68 . . . . 0.0 110.789 -176.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.04 45.15 58.14 Favored Glycine 0 N--CA 1.43 -1.725 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -176.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -85.61 -17.83 35.03 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 121.427 0.632 . . . . 0.0 109.644 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 101.45 16.08 25.7 Favored Glycine 0 N--CA 1.434 -1.449 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.515 173.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -146.71 131.39 17.88 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -177.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.1 mt -100.68 126.93 54.24 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.5 t -107.24 144.72 33.63 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.46 94.21 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.208 0.603 . . . . 0.0 111.782 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.56 89.09 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.093 0.473 . . . . 0.0 110.802 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.555 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 5.0 tp10 -72.15 -45.36 60.8 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.498 178.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.498 ' O ' ' HG2' ' A' ' 109' ' ' MET . 8.5 tt -60.23 -37.81 81.49 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 -176.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.409 ' HB2' HG21 ' A' ' 121' ' ' VAL . 45.8 ttt180 -63.14 -37.15 86.06 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.727 177.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.555 ' HB2' ' O ' ' A' ' 104' ' ' GLU . 56.7 m170 -51.98 -53.51 40.66 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.365 177.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.574 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.3 p -71.02 -30.61 42.01 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.621 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.335 -176.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.498 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.2 mmt -63.6 -47.02 83.16 Favored 'General case' 0 CA--C 1.494 -1.209 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.7 m -62.11 -32.75 73.35 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.406 177.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -73.48 -33.57 64.89 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.216 177.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 84.9 mt -84.65 -20.87 30.62 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.009 0.433 . . . . 0.0 110.986 -176.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 89.48 18.12 53.23 Favored Glycine 0 N--CA 1.431 -1.685 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.1 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -84.58 107.57 16.87 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 176.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -70.3 99.63 1.58 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.4 -177.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 62.9 mt -137.1 149.04 47.09 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -89.86 173.83 8.03 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -66.94 -34.17 77.19 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -61.28 -47.41 86.13 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.519 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -62.68 -48.76 77.91 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.459 -177.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.409 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.2 m -66.96 -33.42 63.27 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 CA-C-O 121.014 0.435 . . . . 0.0 110.9 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -74.35 -37.12 63.59 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.0 0.429 . . . . 0.0 109.971 178.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.615 ' HG3' ' CE1' ' B' ' 81' ' ' PHE . 8.3 tp10 -61.44 -41.6 97.45 Favored 'General case' 0 C--O 1.248 1.025 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.42 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 62.3 mtt -53.71 -56.83 13.9 Favored 'General case' 0 CA--C 1.504 -0.804 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.752 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.9 mm -57.9 -50.57 77.38 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.724 0 CA-C-N 114.482 -1.236 . . . . 0.0 111.451 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -61.43 -21.67 64.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.488 ' HB2' ' CE1' ' B' ' 81' ' ' PHE . 15.1 tp10 -83.81 -36.91 23.16 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.795 176.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.86 -31.04 40.41 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 120.904 0.383 . . . . 0.0 110.525 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.38 94.65 0.96 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.208 1.403 . . . . 0.0 109.532 175.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.67 -38.89 15.39 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.921 -176.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -74.76 -10.71 59.77 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.777 -176.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.72 45.63 27.38 Favored Glycine 0 N--CA 1.441 -0.984 0 C-N-CA 120.664 -0.779 . . . . 0.0 111.538 178.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -105.37 -15.94 14.89 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.858 0.837 . . . . 0.0 109.664 -176.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.03 5.04 73.98 Favored Glycine 0 CA--C 1.495 -1.176 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -143.71 125.53 15.16 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -89.21 128.18 41.44 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.274 0 O-C-N 123.556 0.535 . . . . 0.0 110.131 -179.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -91.12 170.97 9.58 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.977 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.61 ' O ' HG12 ' A' ' 142' ' ' VAL . 81.6 t80 -54.34 -44.79 72.41 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -175.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -68.58 -25.53 64.93 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -81.27 -39.1 25.79 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -67.22 -43.03 83.04 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.699 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.61 HG12 ' O ' ' A' ' 138' ' ' TYR . 27.1 m -53.78 -36.52 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -68.83 -42.21 77.5 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.765 -177.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 27.9 ttt -86.5 -30.24 22.13 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.41 -178.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.411 ' SD ' HG21 ' B' ' 89' ' ' ILE . 14.5 tpt -68.69 -26.56 65.35 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.313 178.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 15.3 t -81.17 -34.8 32.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.191 177.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -113.23 105.43 13.42 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -173.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? . . . . . 0 C--N 1.31 -1.126 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 176.653 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 14.3 p . . . . . 0 N--CA 1.44 -0.964 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -36.79 99.62 0.03 OUTLIER 'Trans proline' 0 C--N 1.385 2.455 0 C-N-CA 125.073 3.849 . . . . 0.0 115.341 -178.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . 0.418 ' HA ' ' O ' ' B' ' 79' ' ' PHE . . . -156.46 17.42 0.33 Allowed 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.856 177.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -102.8 -46.59 4.66 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.16 -175.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 16.1 m -83.22 -40.49 19.56 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.418 ' O ' ' HA ' ' B' ' 76' ' ' ALA . 86.6 m-85 -134.41 145.44 48.91 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 174.343 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.6 m80 -82.68 21.36 1.0 Allowed 'General case' 0 C--N 1.287 -2.131 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -169.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . 0.615 ' CE1' ' HG3' ' A' ' 123' ' ' GLU . 54.3 m-85 -39.13 -59.25 1.03 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 116.072 1.879 . . . . 0.0 116.072 -170.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -76.72 -29.33 56.16 Favored 'General case' 0 C--N 1.315 -0.934 0 C-N-CA 118.768 -1.173 . . . . 0.0 113.186 -173.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . 0.404 ' O ' ' HB3' ' B' ' 86' ' ' LYS . 37.1 mt-10 -81.63 -27.43 34.14 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.189 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.8 -50.88 54.51 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.556 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.522 ' O ' HG12 ' B' ' 89' ' ' ILE . 84.5 m95 -63.66 -32.19 73.6 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.487 176.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' B' ' 83' ' ' GLU . 37.8 ttpt -54.09 -58.45 7.27 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 175.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -57.35 -45.54 84.24 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 114.28 -1.327 . . . . 0.0 111.78 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.93 -61.5 2.34 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 124.402 1.064 . . . . 0.0 112.501 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.522 HG12 ' O ' ' B' ' 85' ' ' TRP . 36.7 pt -65.14 -36.26 77.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -174.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . 0.463 ' HB3' ' O ' ' B' ' 95' ' ' MET . 26.3 mt-30 -64.33 -55.93 17.91 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . 0.402 ' CG ' ' HB3' ' A' ' 112' ' ' LEU . 3.4 tppp? -68.32 -31.54 71.03 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.645 -174.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.88 -37.34 73.03 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.873 178.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -77.89 -1.6 32.58 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-O 121.876 0.846 . . . . 0.0 109.961 177.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 20.7 t60 71.39 29.4 2.74 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.119 1.368 . . . . 0.0 110.076 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.463 ' O ' ' HB3' ' B' ' 90' ' ' GLN . 59.6 ttp -113.56 95.59 37.04 Favored Pre-proline 0 N--CA 1.425 -1.683 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 176.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.459 ' HB3' ' NE2' ' A' ' 41' ' ' GLN . 88.3 Cg_exo -48.21 -74.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.957 2.438 . . . . 0.0 112.361 -177.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . 0.401 ' H ' ' HB2' ' B' ' 96' ' ' PRO . 16.6 t70 177.11 99.13 0.12 Allowed Pre-proline 0 CA--C 1.513 -0.465 0 C-N-CA 123.107 0.563 . . . . 0.0 110.037 172.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -103.4 38.14 0.05 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.39 0 C-N-CA 122.895 2.397 . . . . 0.0 109.181 173.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 27.6 t90 -96.63 121.89 38.95 Favored 'General case' 0 CA--C 1.485 -1.526 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.849 -174.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.409 -2.499 0 CA-C-N 114.27 -1.332 . . . . 0.0 108.422 177.976 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 111.253 0.094 . . . . 0.0 111.253 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -138.96 -7.4 1.4 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 173.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -72.36 114.47 10.51 Favored 'General case' 0 CA--C 1.501 -0.935 0 CA-C-O 121.449 0.642 . . . . 0.0 110.339 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.7 tp -132.65 139.58 47.79 Favored 'General case' 0 C--N 1.275 -2.665 0 N-CA-C 103.891 -2.633 . . . . 0.0 103.891 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.2 p -68.18 148.02 51.45 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.602 -0.839 . . . . 0.0 109.254 -177.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -61.94 -25.66 67.73 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.0 0.429 . . . . 0.0 110.591 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -64.94 -51.23 62.99 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.034 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -65.52 -35.17 80.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.788 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.521 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 51.5 mt -67.57 -32.31 56.41 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.269 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.125 177.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.59 -40.53 88.94 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 175.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.45 -43.07 97.22 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.063 175.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -73.61 -15.41 61.27 Favored 'General case' 0 C--O 1.169 -3.179 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 68.6 mttm -72.97 -42.99 62.78 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 119.251 0.932 . . . . 0.0 108.636 175.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -62.36 -50.07 73.03 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.51 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.64 -40.74 97.62 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.137 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.44 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 92.8 t80 -60.17 -48.63 80.93 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 123.289 0.636 . . . . 0.0 110.094 178.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 m -69.3 -17.52 63.74 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 123.426 0.453 . . . . 0.0 111.464 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.88 -34.88 78.75 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 174.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.593 ' CD2' HG23 ' A' ' 35' ' ' VAL . 17.1 m-85 -90.31 -44.98 9.34 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.001 177.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -87.27 83.34 7.39 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -71.55 -15.57 62.29 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -170.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.48 ' OD1' ' HB3' ' A' ' 24' ' ' ASP . 4.3 p-10 -97.37 -9.85 26.65 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 118.885 -1.126 . . . . 0.0 110.007 177.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.87 50.58 66.0 Favored Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.403 -0.817 . . . . 0.0 113.373 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.48 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 1.2 p-10 -104.08 -17.3 14.99 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.544 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.54 2.53 50.25 Favored Glycine 0 N--CA 1.436 -1.35 0 C-N-CA 120.022 -1.085 . . . . 0.0 114.513 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 52.9 p -137.31 129.44 29.32 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.606 1.203 . . . . 0.0 109.346 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.1 mt -96.29 122.21 47.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 -174.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -94.84 163.44 13.34 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.039 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 34.1 p -63.55 -30.85 71.91 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.801 0.334 . . . . 0.0 111.5 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -59.93 -46.48 89.25 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.134 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -63.18 -46.87 85.09 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.53 ' O ' ' HE2' ' A' ' 36' ' ' MET . 92.7 mt -54.15 -55.57 26.53 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.21 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.7 -31.56 76.31 Favored Glycine 0 C--N 1.305 -1.165 0 C-N-CA 119.328 -1.415 . . . . 0.0 113.131 -176.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 48.5 m -66.02 -46.73 76.85 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 117.04 0.42 . . . . 0.0 110.569 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.593 HG23 ' CD2' ' A' ' 19' ' ' PHE . 34.1 m -70.02 -37.34 72.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.108 178.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.53 ' HE2' ' O ' ' A' ' 32' ' ' LEU . 1.9 mpp? -64.62 -39.83 94.4 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.528 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.552 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 22.3 ttt180 -66.49 -34.02 76.99 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 121.091 0.472 . . . . 0.0 110.148 178.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.8 m -69.69 -25.68 64.0 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.547 -0.752 . . . . 0.0 109.716 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.6 mt -87.29 -1.62 58.04 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.972 177.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 102.34 -10.0 56.29 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.679 176.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.552 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 60.9 tt0 -95.76 138.85 32.82 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -177.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.41 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -117.95 81.68 16.19 Favored Pre-proline 0 C--N 1.301 -1.543 0 O-C-N 121.609 -0.682 . . . . 0.0 109.822 177.446 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -84.85 149.78 11.05 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 122.293 1.995 . . . . 0.0 111.793 178.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.3 p -90.27 170.28 10.4 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.322 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -55.35 -47.36 75.84 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.447 1.099 . . . . 0.0 110.073 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -45.34 84.13 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.776 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 51' ' ' MET . 42.9 mt-10 -65.61 -44.25 87.09 Favored 'General case' 0 C--O 1.221 -0.431 0 O-C-N 123.655 0.597 . . . . 0.0 111.557 -177.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.9 mt -69.02 -39.27 79.37 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.277 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -71.25 -33.74 70.11 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.89 -36.88 84.8 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.413 0.625 . . . . 0.0 109.394 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.487 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 94.8 mmm -67.51 -47.37 70.19 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.222 177.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 58.5 mt -59.59 -44.12 92.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.18 0.514 . . . . 0.0 110.444 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -55.55 -28.52 55.36 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 114.908 1.448 . . . . 0.0 114.908 -173.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -69.04 -27.24 65.48 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 119.198 -1.001 . . . . 0.0 112.591 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.7 m -101.67 -11.81 8.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.579 0.705 . . . . 0.0 109.794 177.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -87.92 75.7 8.78 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.423 -173.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.6 -20.57 39.52 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.606 0.717 . . . . 0.0 109.798 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -82.38 -6.96 59.61 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.312 178.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 59.54 43.46 97.57 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 115.895 1.118 . . . . 0.0 115.895 172.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -109.64 -1.33 18.17 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 119.252 -0.979 . . . . 0.0 110.721 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 69.34 23.15 76.48 Favored Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.603 -0.726 . . . . 0.0 113.423 176.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -141.29 149.77 41.68 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 52.3 mt -103.87 114.79 44.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.422 ' HB2' ' HD2' ' A' ' 66' ' ' PRO . 1.2 p30 -78.68 163.25 25.6 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 119.724 -0.791 . . . . 0.0 110.261 174.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.439 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 31.8 t80 -54.21 -50.5 84.3 Favored Pre-proline 0 C--N 1.313 -1.017 0 O-C-N 123.913 0.758 . . . . 0.0 110.879 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.439 ' HD3' ' HB3' ' A' ' 65' ' ' PHE . 59.5 Cg_exo -47.2 -51.58 9.21 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 122.233 1.955 . . . . 0.0 112.739 171.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.08 -47.13 81.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.324 0.583 . . . . 0.0 110.468 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.44 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 37.4 t80 -61.56 -42.99 99.65 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.31 -177.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 90.9 mt -63.61 -44.14 94.83 Favored 'General case' 0 CA--C 1.504 -0.804 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.542 177.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.4 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 36.0 m -59.25 -47.72 84.3 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.778 0.674 . . . . 0.0 109.843 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.2 ttp -60.96 -41.33 96.13 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.428 179.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 21.3 mmt -69.27 -42.45 75.52 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 178.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.31 -39.63 93.63 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.816 0.341 . . . . 0.0 110.303 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 70' ' ' THR . 99.6 mtt180 -61.77 -39.59 92.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.927 175.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -80.63 -3.52 50.76 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 122.228 1.013 . . . . 0.0 110.445 -175.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 51.5 ttm -102.63 -1.36 30.36 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-O 121.798 0.809 . . . . 0.0 108.885 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -139.2 22.31 2.58 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 122.104 0.954 . . . . 0.0 109.415 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -103.76 -15.67 15.66 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.994 0.902 . . . . 0.0 111.108 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 28.2 m -84.58 -20.66 31.11 Favored 'General case' 0 C--N 1.263 -3.174 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.17 -170.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -82.06 -12.79 58.07 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 119.877 -0.729 . . . . 0.0 109.781 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.1 m -105.27 1.78 28.39 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 172.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 54.68 29.87 12.38 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.078 1.351 . . . . 0.0 113.607 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.481 ' O ' ' HB2' ' A' ' 87' ' ' GLU . 51.2 mm-40 -52.48 -62.42 1.65 Allowed 'General case' 0 C--O 1.202 -1.409 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -179.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -48.16 -45.82 33.92 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.228 1.011 . . . . 0.0 111.464 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 4.5 mm -69.8 -52.42 31.67 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.012 -171.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.4 ttp180 -75.97 -22.27 56.1 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.278 -177.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.481 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 6.4 tp10 -64.6 -52.27 58.4 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 176.05 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.6 -37.91 88.1 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 114.484 -1.235 . . . . 0.0 110.231 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -65.15 -46.56 80.38 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.457 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -69.73 -27.56 65.06 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.646 0.778 . . . . 0.0 112.752 -175.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 13.7 p -72.97 -20.13 18.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 119.464 -0.895 . . . . 0.0 110.438 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -91.5 -60.57 1.85 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 173.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.4 ' CG ' ' H ' ' A' ' 97' ' ' ASN . 14.0 t0 -86.81 82.72 7.73 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 122.689 1.233 . . . . 0.0 109.224 177.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.499 ' HB2' ' HZ2' ' A' ' 94' ' ' LYS . 7.2 mtmp? -78.11 -29.64 49.07 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.949 -174.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -85.68 -13.06 49.68 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-O 121.356 0.598 . . . . 0.0 110.329 -174.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.98 63.34 2.31 Favored Glycine 0 N--CA 1.426 -2.013 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 179.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.4 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 38.5 m-80 -92.33 -19.17 22.41 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.55 13.68 79.7 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -166.62 153.49 9.07 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 124.316 1.046 . . . . 0.0 109.587 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.4 mt -110.94 128.3 67.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 178.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 19.1 m -103.53 160.36 14.8 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.09 -45.01 94.13 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 122.256 0.222 . . . . 0.0 111.338 -178.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.44 -43.8 88.91 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 123.75 0.656 . . . . 0.0 110.302 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -57.76 -56.58 20.09 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.094 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.419 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.0 tm? -58.68 -44.65 90.28 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.295 -1.321 . . . . 0.0 108.995 -173.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.42 ' HB2' HG23 ' A' ' 121' ' ' VAL . 27.8 ttp180 -61.0 -48.74 80.41 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.905 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -60.16 -39.48 86.55 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.472 -178.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.559 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 10.0 p -73.32 -34.3 43.29 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.384 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.488 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.447 ' HG3' HD13 ' A' ' 116' ' ' LEU . 23.1 mmt -63.8 -41.87 97.82 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-N 116.741 -0.209 . . . . 0.0 111.415 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.7 m -62.28 -35.73 79.89 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 176.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -68.81 -33.68 74.25 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.435 0.636 . . . . 0.0 110.381 176.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 52.9 mt -82.86 -16.75 46.4 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.331 -176.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.15 34.86 13.38 Favored Glycine 0 N--CA 1.427 -1.932 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.77 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -103.42 140.69 37.13 Favored 'General case' 0 N--CA 1.418 -2.03 0 C-N-CA 119.722 -0.791 . . . . 0.0 109.795 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -81.43 23.9 0.59 Allowed 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 114.51 -1.223 . . . . 0.0 113.035 -173.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.447 HD13 ' HG3' ' A' ' 109' ' ' MET . 13.9 mt -69.01 132.86 47.32 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 120.605 0.241 . . . . 0.0 110.517 -175.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.8 p -80.43 167.25 20.41 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.018 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -64.47 -28.69 69.84 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 176.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -65.18 -55.11 20.47 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.788 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -55.67 -51.4 67.38 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 123.848 0.717 . . . . 0.0 110.884 -177.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.432 ' O ' HG12 ' A' ' 125' ' ' ILE . 15.2 m -61.22 -37.31 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.354 -177.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -72.51 -44.63 61.95 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.35 0.595 . . . . 0.0 109.709 -178.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.489 ' OE1' ' HD3' ' A' ' 126' ' ' ARG . 4.7 tp10 -67.38 -36.19 80.85 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.253 -176.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.3 mtt -56.13 -54.91 39.4 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.014 174.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.6 mm -57.74 -48.52 83.34 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.81 0 O-C-N 124.226 0.954 . . . . 0.0 110.42 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.489 ' HD3' ' OE1' ' A' ' 123' ' ' GLU . 57.0 ttt180 -59.42 -37.86 79.14 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 123.743 0.817 . . . . 0.0 112.494 -176.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.484 ' HG3' ' CE2' ' B' ' 81' ' ' PHE . 19.0 mm-40 -81.65 -25.14 35.86 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 178.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.88 -28.88 39.89 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 176.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.12 85.35 4.31 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 114.362 -1.29 . . . . 0.0 108.725 173.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 53.9 mt -77.46 -23.9 14.52 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.966 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.35 -176.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -86.5 -10.79 53.36 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 120.503 -0.479 . . . . 0.0 112.197 -175.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.2 41.08 22.64 Favored Glycine 0 C--N 1.317 -0.507 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.474 175.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -101.59 -16.14 16.84 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.73 0.776 . . . . 0.0 109.63 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 96.89 -11.19 66.19 Favored Glycine 0 N--CA 1.441 -0.98 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.471 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -136.36 131.28 34.04 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -178.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 1.5 p -80.73 113.65 20.47 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-O 120.817 0.341 . . . . 0.0 111.761 -177.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -88.46 178.09 6.64 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.498 ' O ' HG13 ' A' ' 142' ' ' VAL . 85.7 t80 -66.76 -39.89 88.04 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -175.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.5 ' O ' HG22 ' A' ' 142' ' ' VAL . 22.5 mm-40 -67.2 -28.82 68.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.321 0.582 . . . . 0.0 110.857 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.11 -33.3 44.48 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.414 0.626 . . . . 0.0 110.367 175.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -75.33 -29.87 60.12 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.831 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 139' ' ' GLU . 31.7 m -60.0 -33.48 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-O 121.247 0.546 . . . . 0.0 110.612 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -71.79 -40.15 69.4 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.729 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 95.9 mmm -69.31 -39.08 78.46 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.172 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 15.5 tpt -67.21 -22.92 65.7 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.62 0.724 . . . . 0.0 110.317 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 7.4 m -96.13 9.28 41.41 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 121.795 0.807 . . . . 0.0 109.714 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -100.78 42.23 1.13 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.3 0.571 . . . . 0.0 110.273 -178.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt . . . . . 0 C--N 1.311 -1.082 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.294 -179.476 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 12.1 m . . . . . 0 CA--C 1.543 0.691 0 CA-C-O 120.798 0.332 . . . . 0.0 110.784 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -80.15 -14.17 12.22 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.213 2.609 . . . . 0.0 114.319 -177.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -77.94 28.41 0.17 Allowed 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -175.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -146.53 113.39 6.09 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.2 m -106.31 10.81 31.56 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.133 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -77.15 159.69 29.56 Favored 'General case' 0 C--O 1.248 1.019 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -175.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 73.5 t60 -67.52 -21.2 65.49 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 114.486 -1.233 . . . . 0.0 111.808 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . 0.484 ' CE2' ' HG3' ' A' ' 127' ' ' GLU . 80.0 m-85 -70.55 -23.84 62.69 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -176.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' B' ' 86' ' ' LYS . 24.8 ttmm -68.61 -44.29 74.59 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 173.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.16 -47.59 79.27 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.75 -58.79 6.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.26 -1.337 . . . . 0.0 111.723 -178.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -67.6 -33.0 74.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' B' ' 82' ' ' LYS . 63.6 tttm -56.13 -57.94 10.03 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 175.116 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -58.44 -40.31 82.23 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.011 -1.45 . . . . 0.0 110.679 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.1 -54.43 44.71 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.803 0.335 . . . . 0.0 111.312 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 80.9 mt -62.78 -38.97 83.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.548 0.69 . . . . 0.0 109.505 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . 0.482 ' O ' ' HA ' ' B' ' 94' ' ' HIS . 6.2 tt0 -58.03 -42.91 86.34 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 124.952 1.301 . . . . 0.0 111.548 177.16 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -81.0 -42.73 20.7 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.829 -177.085 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.32 -52.34 9.34 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -175.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 18.0 ttpt -91.41 -11.02 38.94 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -174.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . 0.482 ' HA ' ' O ' ' B' ' 90' ' ' GLN . 62.1 m170 70.99 100.27 0.06 Allowed 'General case' 0 CA--C 1.502 -0.897 0 C-N-CA 124.021 0.929 . . . . 0.0 110.035 -172.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.492 ' N ' ' HD3' ' B' ' 96' ' ' PRO . 26.7 ttt -129.21 65.52 74.37 Favored Pre-proline 0 C--N 1.312 -1.057 0 C-N-CA 119.022 -1.071 . . . . 0.0 113.687 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.492 ' HD3' ' N ' ' B' ' 95' ' ' MET . 44.4 Cg_endo -106.36 41.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 124.087 3.191 . . . . 0.0 106.291 164.328 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -65.06 137.54 97.11 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 112.974 -1.921 . . . . 0.0 111.149 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.51 62.4 2.19 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.997 2.465 . . . . 0.0 111.083 176.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 23.9 t90 -76.46 79.63 3.17 Favored 'General case' 0 N--CA 1.426 -1.632 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.983 -178.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . 0.551 ' HA ' ' CE1' ' A' ' 19' ' ' PHE . . . . . . . . 0 C--O 1.257 1.449 0 CA-C-N 113.576 -1.647 . . . . 0.0 111.551 -178.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.428 0 N-CA-C 111.284 0.105 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -144.98 -164.9 2.03 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.786 -178.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 81.31 100.73 0.06 Allowed 'General case' 0 C--O 1.24 0.558 0 C-N-CA 125.737 1.615 . . . . 0.0 108.759 -172.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.449 ' HB3' HD13 ' A' ' 9' ' ' ILE . 19.6 tp -108.62 163.48 13.2 Favored 'General case' 0 N--CA 1.42 -1.929 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.436 -172.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.1 p -85.02 145.14 27.85 Favored 'General case' 0 N--CA 1.413 -2.308 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.574 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -51.69 -40.24 59.73 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 125.438 1.495 . . . . 0.0 111.969 -176.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.81 -45.36 89.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.889 -178.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.574 HE21 ' HA ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -65.88 -45.85 80.57 Favored 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 176.997 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.545 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 74.8 mt -57.11 -44.26 82.88 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.352 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.856 -178.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.55 93.6 Favored 'General case' 0 C--O 1.256 1.427 0 CA-C-O 121.393 0.616 . . . . 0.0 111.44 177.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.38 -40.59 96.97 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.664 0.745 . . . . 0.0 109.135 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -73.79 -18.78 60.92 Favored 'General case' 0 C--O 1.189 -2.087 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.509 -178.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.545 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.6 mttt -65.69 -50.78 63.67 Favored 'General case' 0 CA--C 1.504 -0.819 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -45.34 88.4 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.941 177.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.68 87.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.607 179.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -61.99 -45.57 93.06 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 m -68.58 -18.1 64.26 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.957 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -67.18 -41.9 85.12 Favored 'General case' 0 C--O 1.243 0.739 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 172.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.423 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 79.3 m-85 -81.44 -50.94 8.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.872 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -63.41 101.34 0.31 Allowed 'General case' 0 CA--C 1.502 -0.887 0 O-C-N 124.293 0.996 . . . . 0.0 109.038 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 19' ' ' PHE . 41.7 mmtm -71.94 -9.09 57.87 Favored 'General case' 0 N--CA 1.423 -1.8 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.265 -174.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -107.34 -14.35 14.9 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.55 45.09 90.48 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.516 -0.634 . . . . 0.0 111.516 -176.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -112.74 -15.91 12.88 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 122.621 -0.341 . . . . 0.0 111.59 -175.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.82 16.8 20.75 Favored Glycine 0 N--CA 1.43 -1.708 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.111 179.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 68.0 p -142.37 138.67 31.36 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 117.351 0.575 . . . . 0.0 109.804 173.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 67.8 mt -112.99 114.66 47.61 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 176.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 37.2 p -84.41 174.04 10.41 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.162 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.7 p -61.76 -32.83 73.12 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.613 0.721 . . . . 0.0 109.404 174.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -57.56 -55.05 39.9 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 114.639 -1.164 . . . . 0.0 109.051 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -67.23 -39.39 86.2 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.596 -177.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.2 mt -58.38 -50.6 73.1 Favored 'General case' 0 C--O 1.213 -0.821 0 O-C-N 123.133 0.27 . . . . 0.0 111.482 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.09 -30.76 76.24 Favored Glycine 0 C--O 1.214 -1.112 0 C-N-CA 119.488 -1.339 . . . . 0.0 111.836 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.1 m -64.2 -49.45 71.93 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 120.758 0.314 . . . . 0.0 110.456 176.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.1 m -70.22 -37.54 71.75 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.628 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.688 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtt -65.34 -37.74 87.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.73 -0.214 . . . . 0.0 111.09 178.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -63.92 -33.51 75.87 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.932 0.396 . . . . 0.0 110.078 177.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.8 m -71.01 -30.0 66.11 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.482 177.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -84.64 -19.19 33.3 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 110.29 35.74 2.07 Favored Glycine 0 N--CA 1.442 -0.911 0 C-N-CA 120.978 -0.629 . . . . 0.0 114.475 177.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.591 ' OE1' ' HD3' ' B' ' 96' ' ' PRO . 61.3 tt0 -140.06 132.16 27.98 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 171.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.405 HD21 ' N ' ' A' ' 42' ' ' ASN . 0.7 OUTLIER -116.49 83.81 13.97 Favored Pre-proline 0 C--N 1.289 -2.052 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 175.533 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.401 ' HG2' HD22 ' A' ' 48' ' ' LEU . 9.3 Cg_endo -86.96 156.64 8.59 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.583 2.189 . . . . 0.0 112.415 -179.066 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.3 t -82.45 158.29 23.3 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mp0 -59.6 -28.87 67.55 Favored 'General case' 0 C--O 1.21 -1.001 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -43.22 82.86 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.063 0.459 . . . . 0.0 110.696 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -69.21 -44.01 72.95 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.814 0.816 . . . . 0.0 109.456 -178.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.401 HD22 ' HG2' ' A' ' 43' ' ' PRO . 87.8 mt -63.72 -40.49 96.88 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.32 -178.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -64.33 -37.85 88.96 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.168 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -59.21 -42.43 90.95 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 123.708 0.63 . . . . 0.0 109.981 179.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.2 tpp -68.36 -52.99 27.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.949 177.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.1 mt -54.76 -49.15 71.06 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.749 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.629 -178.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -58.76 -20.75 52.4 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 123.953 0.901 . . . . 0.0 113.132 -172.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -73.74 -43.02 60.29 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-O 121.214 0.53 . . . . 0.0 110.068 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.442 HG13 ' HB2' ' A' ' 71' ' ' MET . 26.6 m -90.72 -15.41 8.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.896 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -81.57 88.78 6.18 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.681 -178.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.79 -13.16 45.94 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -91.19 -10.33 42.09 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -178.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 74.15 29.02 63.12 Favored Glycine 0 N--CA 1.439 -1.106 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.512 177.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -96.35 -16.48 21.27 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 117.607 0.704 . . . . 0.0 111.784 177.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.69 23.34 64.79 Favored Glycine 0 N--CA 1.441 -1.013 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.7 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 15.2 p -138.42 137.24 37.04 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' A' ' 26' ' ' THR . 54.3 mt -89.61 110.37 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.963 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -175.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -79.89 162.6 24.91 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.486 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 68.3 t80 -52.84 -53.02 59.34 Favored Pre-proline 0 C--N 1.307 -1.252 0 CA-C-O 119.061 -0.495 . . . . 0.0 112.155 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -50.99 -42.23 53.28 Favored 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 122.679 2.253 . . . . 0.0 112.715 174.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -68.48 -35.88 78.17 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.265 0.555 . . . . 0.0 110.287 -179.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -66.29 -39.87 89.67 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 85.8 mt -63.21 -44.12 96.19 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.596 176.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 57.4 m -55.14 -50.18 69.91 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 123.676 0.61 . . . . 0.0 109.809 176.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.442 ' HB2' HG13 ' A' ' 55' ' ' VAL . 31.5 ttp -59.46 -45.32 91.95 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.603 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 31.8 tpp -67.62 -39.88 84.7 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.27 0.557 . . . . 0.0 110.842 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.11 -24.81 61.54 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.36 -178.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -75.63 -31.73 59.97 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.775 0.798 . . . . 0.0 108.947 172.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -74.46 -54.25 7.93 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.335 -174.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 20.9 ptp -71.25 142.48 50.55 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.257 -176.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.403 ' HD2' ' N ' ' A' ' 77' ' ' LYS . 9.6 mptt -119.6 79.55 1.45 Allowed 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 105.099 -2.186 . . . . 0.0 105.099 172.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.6 t70 61.94 83.05 0.16 Allowed 'General case' 0 C--N 1.319 -0.76 0 O-C-N 124.855 1.347 . . . . 0.0 108.701 -169.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 33.8 m 74.87 140.57 0.07 Allowed 'General case' 0 CA--C 1.561 1.378 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.655 -176.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -120.72 94.09 4.24 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.3 m -137.26 -57.01 0.71 Allowed 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.346 178.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -80.95 -21.51 40.34 Favored 'General case' 0 CA--C 1.496 -1.133 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.306 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -50.86 -37.41 43.2 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.449 ' CD ' ' HZ3' ' B' ' 93' ' ' LYS . 14.6 mm-40 -62.16 -46.03 90.76 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.488 0.661 . . . . 0.0 111.49 175.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.447 HG23 HG13 ' A' ' 142' ' ' VAL . 10.0 mm -70.61 -42.44 77.97 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.556 -176.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -69.34 -34.47 74.67 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.517 -1.22 . . . . 0.0 111.562 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.35 -48.62 79.0 Favored 'General case' 0 CA--C 1.495 -1.171 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.472 ' O ' ' HD2' ' A' ' 92' ' ' PHE . . . -61.0 -44.85 96.81 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 113.238 -1.801 . . . . 0.0 110.701 177.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -63.06 -47.31 83.5 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.086 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -58.17 -35.05 71.0 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 178.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.444 HG11 ' O ' ' A' ' 88' ' ' ALA . 7.9 p -76.59 -28.28 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.278 -178.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.472 ' HD2' ' O ' ' A' ' 88' ' ' ALA . 73.8 m-85 -86.63 -42.29 13.56 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.885 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -73.59 85.56 1.59 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.941 0.877 . . . . 0.0 109.411 177.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -79.44 -42.7 24.81 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.952 -175.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.22 -13.03 51.2 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.859 -175.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.05 54.57 4.07 Favored Glycine 0 C--N 1.307 -1.075 0 C-N-CA 120.149 -1.024 . . . . 0.0 110.558 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -100.22 -19.96 16.15 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.06 2.03 88.36 Favored Glycine 0 C--O 1.24 0.499 0 N-CA-C 110.24 -1.144 . . . . 0.0 110.24 -177.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.439 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 42.4 m-85 -142.22 130.75 22.53 Favored 'General case' 0 N--CA 1.425 -1.686 0 C-N-CA 126.262 1.825 . . . . 0.0 106.38 -178.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 3.0 mt -81.19 126.98 39.91 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.6 t -94.33 150.54 20.18 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.68 -44.88 80.61 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.631 0.253 . . . . 0.0 111.136 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.27 -34.87 78.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.414 0.626 . . . . 0.0 109.643 178.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -67.17 -45.97 75.39 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.057 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.411 ' O ' HG12 ' A' ' 108' ' ' VAL . 3.9 tt -63.6 -40.0 95.82 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 179.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? -61.66 -39.84 92.8 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -58.32 -49.75 76.08 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.629 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.475 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.9 p -68.06 -30.16 47.13 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.667 0 C-N-CA 120.327 -0.549 . . . . 0.0 109.795 -179.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.8 mmt -63.96 -42.25 97.34 Favored 'General case' 0 CA--C 1.491 -1.299 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.7 m -66.4 -32.44 73.82 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -73.56 -29.01 62.16 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.652 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 79.5 mt -91.2 -9.8 44.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.388 0.613 . . . . 0.0 110.165 -178.049 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 75.9 20.37 77.92 Favored Glycine 0 N--CA 1.435 -1.405 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.363 179.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -76.56 -27.53 55.93 Favored 'General case' 0 CA--C 1.495 -1.156 0 CA-C-N 116.98 0.39 . . . . 0.0 110.951 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 59.96 42.64 15.79 Favored 'General case' 0 C--O 1.236 0.362 0 O-C-N 124.32 1.013 . . . . 0.0 111.689 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 58.5 mt -86.27 154.8 21.0 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.487 ' H ' ' CD ' ' A' ' 120' ' ' GLU . 20.7 p -101.78 177.31 4.94 Favored 'General case' 0 N--CA 1.426 -1.626 0 C-N-CA 119.061 -1.056 . . . . 0.0 110.743 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -65.21 -18.55 65.4 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.145 0.498 . . . . 0.0 110.853 -177.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -70.69 -57.05 5.09 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.472 -177.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.487 ' CD ' ' H ' ' A' ' 117' ' ' THR . 3.5 pm0 -70.08 -35.52 74.25 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.336 -177.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.469 ' O ' HG12 ' A' ' 125' ' ' ILE . 5.9 m -70.93 -26.56 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.42 -178.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -72.82 -35.64 67.34 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -67.48 -36.0 80.27 Favored 'General case' 0 C--N 1.352 0.704 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 176.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.416 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 65.2 mtt -55.15 -46.56 75.71 Favored 'General case' 0 CA--C 1.509 -0.608 0 O-C-N 124.145 0.903 . . . . 0.0 109.933 176.271 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 121' ' ' VAL . 51.2 mm -66.32 -53.99 30.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.258 177.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -45.82 -59.66 2.67 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 126.274 1.83 . . . . 0.0 114.555 -174.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.666 ' HB2' ' CE1' ' B' ' 81' ' ' PHE . 12.2 mm-40 -69.44 -20.08 63.77 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.921 0.391 . . . . 0.0 111.64 -176.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -92.31 -21.26 20.38 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.636 0.732 . . . . 0.0 110.154 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -79.6 73.26 6.3 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 122.323 1.059 . . . . 0.0 110.282 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 27.9 mt -82.98 -9.71 11.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 CA-C-N 114.605 -1.18 . . . . 0.0 108.757 176.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -84.8 -11.84 54.9 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.46 0.648 . . . . 0.0 109.537 -178.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 65.7 36.26 92.11 Favored Glycine 0 N--CA 1.436 -1.313 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.453 177.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -101.29 -16.38 16.96 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.329 0.585 . . . . 0.0 110.289 -176.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.15 0.25 68.19 Favored Glycine 0 C--N 1.312 -0.796 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -176.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.439 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 21.3 mt-30 -144.36 138.91 28.15 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 1.3 p -83.45 118.98 31.93 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -176.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.424 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 37.7 t30 -73.8 156.3 37.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.788 1.235 . . . . 0.0 110.489 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.459 ' O ' HG12 ' A' ' 142' ' ' VAL . 80.2 t80 -56.81 -48.79 77.18 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 122.738 0.415 . . . . 0.0 111.725 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.461 ' O ' HG22 ' A' ' 142' ' ' VAL . 27.0 mm-40 -65.98 -33.93 76.94 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.994 0.426 . . . . 0.0 111.971 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -71.67 -34.5 69.76 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 121.219 0.533 . . . . 0.0 110.157 175.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -68.34 -42.46 79.24 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.81 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 139' ' ' GLU . 8.9 m -63.58 -36.61 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 120.283 -0.567 . . . . 0.0 109.646 178.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -64.7 -49.5 70.64 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.712 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -69.41 -44.61 71.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.515 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.7 tpt -65.66 -38.04 88.22 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 111.455 0.169 . . . . 0.0 111.455 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 74.5 m -81.15 -8.69 59.81 Favored 'General case' 0 CA--C 1.559 1.312 0 CA-C-O 121.258 0.552 . . . . 0.0 110.469 177.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.57 102.99 8.22 Favored 'General case' 0 C--O 1.249 1.076 0 O-C-N 121.811 -0.555 . . . . 0.0 110.042 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm . . . . . 0 C--O 1.254 1.297 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.138 178.898 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.448 -0.53 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -80.28 10.99 3.0 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.236 2.624 . . . . 0.0 112.71 -178.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -50.17 115.22 1.33 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.619 1.168 . . . . 0.0 113.047 -177.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 55.65 -87.23 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.255 1.822 . . . . 0.0 113.9 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 44.7 m -99.21 23.4 9.21 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.241 0.543 . . . . 0.0 109.596 -179.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 66.58 23.09 10.43 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.811 1.244 . . . . 0.0 110.37 177.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -140.72 92.13 2.48 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.778 -178.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . 0.666 ' CE1' ' HB2' ' A' ' 127' ' ' GLU . 89.3 t80 -86.52 -39.27 16.4 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -64.16 -50.41 68.27 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.896 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -61.96 -35.72 79.31 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 123.099 0.559 . . . . 0.0 110.273 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.25 -55.83 28.95 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.474 179.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.552 ' O ' HG12 ' B' ' 89' ' ' ILE . 35.9 m95 -67.43 -37.56 83.21 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 177.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -54.37 -56.78 15.17 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -63.14 -27.83 69.64 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.259 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.36 -55.16 8.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.618 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.552 HG12 ' O ' ' B' ' 85' ' ' TRP . 44.7 mm -57.38 -50.53 76.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.831 0.824 . . . . 0.0 109.188 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . 0.551 ' NE2' ' HB2' ' A' ' 41' ' ' GLN . 29.9 tt0 -61.51 -43.29 99.13 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 113.949 -1.478 . . . . 0.0 112.278 -176.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -76.15 -31.46 58.58 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.325 -0.55 . . . . 0.0 111.337 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.09 -38.08 89.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.545 0.688 . . . . 0.0 109.621 177.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.449 ' HZ3' ' CD ' ' A' ' 84' ' ' GLU . 38.0 mttm -74.86 -32.12 61.8 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.599 175.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 27.9 t60 90.67 -27.64 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 127.686 2.394 . . . . 0.0 109.778 -176.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 25.7 mmt -137.98 151.1 69.47 Favored Pre-proline 0 C--N 1.303 -1.451 0 N-CA-C 105.839 -1.912 . . . . 0.0 105.839 177.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.591 ' HD3' ' OE1' ' A' ' 41' ' ' GLN . 12.5 Cg_exo -70.19 -17.98 35.26 Favored 'Trans proline' 0 C--O 1.223 -0.236 0 C-N-CA 121.186 1.258 . . . . 0.0 109.93 176.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 82.18 137.34 0.05 OUTLIER Pre-proline 0 CA--C 1.51 -0.591 0 C-N-CA 126.605 1.962 . . . . 0.0 111.124 -175.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -76.7 101.59 1.52 Allowed 'Trans proline' 0 N--CA 1.443 -1.486 0 C-N-CA 121.439 1.426 . . . . 0.0 109.786 176.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -82.59 161.14 22.36 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.612 0.72 . . . . 0.0 111.007 -178.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.414 -2.267 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 172.914 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.69 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -145.25 -9.76 0.57 Allowed 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -110.65 153.92 24.55 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.445 ' HB3' HD13 ' A' ' 9' ' ' ILE . 20.1 tp -132.57 158.17 42.85 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -176.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.1 p -77.31 151.03 35.19 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.585 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -59.09 -36.1 74.55 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -176.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -58.85 -52.83 64.06 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 121.261 0.553 . . . . 0.0 109.72 177.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -62.58 -46.69 87.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.032 -177.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.509 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 75.2 mt -60.0 -36.71 68.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 O-C-N 123.588 0.555 . . . . 0.0 111.084 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.19 -44.93 86.83 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-O 120.647 0.26 . . . . 0.0 110.527 177.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -61.57 -36.63 81.19 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.717 176.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.451 ' CZ ' ' HG2' ' A' ' 72' ' ' MET . 56.0 m-85 -72.32 -33.94 67.71 Favored 'General case' 0 C--O 1.185 -2.323 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 177.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.509 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 99.2 mttt -59.03 -42.99 91.54 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.756 0.788 . . . . 0.0 109.794 176.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.34 -54.46 40.17 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.592 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.9 -31.44 69.23 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.042 -176.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.4 ' CD2' ' HD2' ' A' ' 65' ' ' PHE . 63.1 t80 -63.11 -48.25 79.33 Favored 'General case' 0 C--O 1.206 -1.237 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 177.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -68.84 -17.33 63.98 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.251 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.6 tp -72.0 -31.8 66.58 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.414 0.626 . . . . 0.0 110.04 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.455 ' CD2' HG22 ' A' ' 35' ' ' VAL . 10.5 m-85 -95.75 -35.86 11.39 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.114 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -77.64 99.38 5.77 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 175.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.69 -21.89 66.85 Favored 'General case' 0 C--N 1.307 -1.251 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -173.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.436 ' OD2' ' HB3' ' A' ' 24' ' ' ASP . 7.5 p-10 -113.12 -13.32 13.04 Favored 'General case' 0 C--N 1.305 -1.353 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.517 179.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.33 57.01 7.89 Favored Glycine 0 C--O 1.242 0.62 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.686 176.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.436 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 2.9 p-10 -112.91 -13.93 13.09 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 120.956 0.407 . . . . 0.0 110.518 -177.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.28 6.95 44.17 Favored Glycine 0 N--CA 1.433 -1.545 0 C-N-CA 121.172 -0.537 . . . . 0.0 112.79 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.423 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 74.6 p -137.78 131.27 30.97 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 117.288 0.544 . . . . 0.0 109.68 175.005 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.3 mt -102.26 124.99 56.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.993 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 177.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 27.0 p -94.3 167.7 11.37 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.294 178.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 40.0 p -64.82 -26.36 68.31 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 120.901 0.381 . . . . 0.0 110.238 177.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -55.32 -60.65 3.11 Favored 'General case' 0 C--O 1.242 0.668 0 C-N-CA 124.16 0.984 . . . . 0.0 108.941 174.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.88 -42.95 98.94 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 113.986 -1.461 . . . . 0.0 109.873 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.631 ' O ' ' HE2' ' A' ' 36' ' ' MET . 74.9 mt -56.43 -61.73 2.21 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.878 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.17 -31.84 82.11 Favored Glycine 0 C--N 1.309 -0.969 0 C-N-CA 119.303 -1.427 . . . . 0.0 113.43 -174.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.6 m -67.59 -44.46 78.06 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 116.864 0.332 . . . . 0.0 111.068 178.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.503 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 31.3 m -71.48 -35.98 58.84 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 C-N-CA 119.699 -0.801 . . . . 0.0 110.152 178.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.631 ' HE2' ' O ' ' A' ' 32' ' ' LEU . 1.5 mpp? -64.11 -44.4 92.38 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.866 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -64.69 -33.42 75.9 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.86 0.362 . . . . 0.0 110.198 178.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 m -70.77 -21.46 62.5 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.091 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 92.2 mt -88.98 -22.77 22.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.71 0.291 . . . . 0.0 110.45 177.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.89 3.44 31.93 Favored Glycine 0 C--N 1.314 -0.693 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.728 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.43 ' C ' HD21 ' A' ' 42' ' ' ASN . 10.2 tp60 -101.47 131.47 47.58 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.43 HD21 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.47 79.87 37.84 Favored Pre-proline 0 C--N 1.298 -1.658 0 C-N-CA 119.709 -0.796 . . . . 0.0 112.704 177.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -78.81 153.97 26.2 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 121.703 1.602 . . . . 0.0 108.675 169.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.41 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 47.6 p -81.85 173.33 12.36 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.134 -178.02 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -59.12 -40.76 86.42 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 123.827 0.851 . . . . 0.0 110.658 -176.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.43 -35.87 68.43 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.248 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.41 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 23.0 mm-40 -60.51 -47.97 83.8 Favored 'General case' 0 C--O 1.241 0.607 0 O-C-N 123.502 0.501 . . . . 0.0 110.943 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.445 ' O ' HG13 ' A' ' 52' ' ' ILE . 78.9 mt -62.43 -41.06 98.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.129 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -67.52 -36.57 81.29 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.548 -177.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -67.57 -42.03 83.23 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.013 0.435 . . . . 0.0 109.983 178.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.726 ' SD ' ' HA ' ' B' ' 96' ' ' PRO . 46.5 tpp -60.06 -36.8 78.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.97 -1.013 . . . . 0.0 109.653 178.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 48' ' ' LEU . 49.0 mt -65.84 -50.21 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.143 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.4 175.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -60.98 -23.39 65.32 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -174.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.68 -44.4 73.32 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 123.98 0.912 . . . . 0.0 109.238 175.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.8 m -105.6 -15.49 8.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -177.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -72.17 103.8 3.44 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.062 0.458 . . . . 0.0 111.581 -176.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.07 -21.61 25.95 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.325 -179.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.05 -12.08 57.48 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.277 -174.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 62.8 29.84 75.22 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -173.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -100.12 -8.98 23.05 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.199 0.523 . . . . 0.0 110.853 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 86.82 12.83 68.07 Favored Glycine 0 N--CA 1.432 -1.602 0 CA-C-N 115.856 -0.611 . . . . 0.0 114.018 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.423 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 53.9 p -132.35 150.86 52.07 Favored 'General case' 0 C--O 1.255 1.363 0 CA-C-N 117.919 0.859 . . . . 0.0 111.124 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 86.1 mt -91.76 112.35 25.45 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.719 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -80.28 153.11 28.68 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 175.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.435 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 31.2 t80 -53.03 -50.15 83.51 Favored Pre-proline 0 CA--C 1.553 1.096 0 O-C-N 123.429 0.456 . . . . 0.0 111.93 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.435 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.1 Cg_endo -49.72 -47.55 22.62 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.653 2.235 . . . . 0.0 112.872 173.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -62.74 -41.42 99.17 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 121.786 0.803 . . . . 0.0 110.425 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.491 ' CZ ' ' HB2' ' B' ' 100' ' ' ALA . 4.9 t80 -61.43 -43.97 97.95 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.382 176.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.6 mt -62.91 -35.11 78.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.937 178.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.9 m -58.68 -53.54 57.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 122.617 0.367 . . . . 0.0 111.191 178.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -64.97 -31.55 72.84 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.856 -177.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.451 ' HG2' ' CZ ' ' A' ' 12' ' ' PHE . 13.1 tpp -79.21 -38.75 34.95 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 119.66 -0.816 . . . . 0.0 110.978 -176.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.75 -24.31 62.59 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-O 120.682 0.277 . . . . 0.0 110.942 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -72.34 -27.34 62.35 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 121.244 0.545 . . . . 0.0 110.289 174.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.619 ' HD2' ' SD ' ' B' ' 95' ' ' MET . 47.6 tttp -78.68 -47.76 16.34 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 176.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 65.6 mtp -83.12 62.74 6.78 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 113.976 -1.465 . . . . 0.0 110.927 -177.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -125.34 -169.72 2.04 Favored 'General case' 0 N--CA 1.41 -2.439 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 177.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -81.73 97.09 7.77 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 175.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.4 m -87.96 86.01 7.07 Favored 'General case' 0 N--CA 1.419 -1.994 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 176.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -90.89 3.07 55.55 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 114.715 -1.129 . . . . 0.0 110.581 -175.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 58.9 p -102.48 -176.91 3.24 Favored 'General case' 0 N--CA 1.402 -2.836 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.17 3.87 46.62 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 47.5 mt-10 -53.59 -63.4 1.16 Allowed 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -170.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -83.95 -21.65 31.73 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 121.739 0.78 . . . . 0.0 109.589 -176.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.4 mm -66.75 -47.33 83.26 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.407 -172.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -73.28 -30.5 63.45 Favored 'General case' 0 N--CA 1.423 -1.82 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.45 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 39.4 mt-10 -64.63 -46.22 83.48 Favored 'General case' 0 C--O 1.247 0.938 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.115 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.455 ' O ' HG11 ' A' ' 91' ' ' VAL . . . -67.68 -42.51 81.99 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.274 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -60.06 -45.63 92.24 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 178.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -60.85 -31.08 70.53 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.649 0.78 . . . . 0.0 112.465 -179.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.455 HG11 ' O ' ' A' ' 88' ' ' ALA . 14.5 p -79.52 -27.27 12.78 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 C-N-CA 119.173 -1.011 . . . . 0.0 111.63 -179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -82.14 -52.53 6.9 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -87.84 81.47 7.56 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 122.558 1.17 . . . . 0.0 108.159 175.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -76.09 -29.71 58.04 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 113.24 -1.8 . . . . 0.0 110.575 -174.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -73.97 -13.79 60.93 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.198 0.523 . . . . 0.0 110.72 178.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 66.24 42.83 93.98 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.981 -0.554 . . . . 0.0 113.491 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -98.56 -10.7 23.05 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 122.576 -0.367 . . . . 0.0 111.91 -179.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 102.19 4.45 50.55 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.357 -0.925 . . . . 0.0 113.24 174.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -151.99 132.42 13.78 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-O 121.168 0.509 . . . . 0.0 111.266 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.1 mt -79.11 128.59 38.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 -177.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.6 t -113.61 145.32 41.45 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 176.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.49 -50.45 62.71 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -173.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.36 -44.08 84.06 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 123.278 0.361 . . . . 0.0 111.86 -177.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -71.89 -37.74 70.08 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.992 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.477 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.1 tt -60.59 -43.5 97.3 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 178.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -64.41 -45.53 87.21 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 23.2 t-80 -59.2 -46.95 87.08 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.391 -178.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.547 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.2 p -66.38 -36.69 77.95 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.131 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.724 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.5 mmt -59.88 -42.27 93.4 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-O 120.699 0.285 . . . . 0.0 111.552 178.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 16.4 m -62.07 -35.42 78.6 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.633 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -74.39 -32.38 62.69 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.371 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 60.9 mt -84.9 -20.14 31.21 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.722 -174.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.68 35.61 6.8 Favored Glycine 0 N--CA 1.423 -2.179 0 C-N-CA 119.773 -1.204 . . . . 0.0 111.792 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.542 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 11.0 tp10 -120.19 111.98 18.51 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 176.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -80.28 94.36 6.08 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.767 -178.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.423 HD23 ' HG3' ' A' ' 114' ' ' GLU . 15.0 mt -119.89 132.3 55.51 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 105.735 -1.95 . . . . 0.0 105.735 176.033 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.4 p -94.27 -176.86 4.09 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 118.552 -1.259 . . . . 0.0 109.783 178.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -56.46 -42.07 77.57 Favored 'General case' 0 C--O 1.208 -1.098 0 C-N-CA 123.374 0.67 . . . . 0.0 111.585 -175.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -69.62 -24.7 63.69 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 113.399 0.888 . . . . 0.0 113.399 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -79.43 -46.91 16.63 Favored 'General case' 0 CA--C 1.499 -0.998 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.585 175.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 125' ' ' ILE . 13.9 m -65.67 -34.85 73.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.92 -43.13 99.64 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 123.516 0.726 . . . . 0.0 110.453 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.428 ' CD ' ' H2 ' ' B' ' 74' ' ' SER . 3.9 tp10 -65.98 -40.93 91.65 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.401 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 64.2 mtt -60.87 -41.05 95.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.235 178.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.473 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.0 mm -65.26 -53.03 45.14 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.804 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -56.32 -40.7 74.82 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.359 0.664 . . . . 0.0 112.426 -175.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -79.57 -8.17 58.99 Favored 'General case' 0 C--N 1.309 -1.189 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -108.76 -22.58 12.16 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-O 121.3 0.572 . . . . 0.0 110.294 177.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -71.64 95.92 1.51 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 125.087 1.355 . . . . 0.0 109.479 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 63.3 mt -83.74 -48.69 17.05 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.167 -177.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -86.13 -11.3 53.0 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -172.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 84.7 66.87 1.44 Allowed Glycine 0 C--N 1.296 -1.647 0 C-N-CA 120.233 -0.984 . . . . 0.0 112.837 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -112.19 -16.35 13.02 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 177.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.06 5.41 67.92 Favored Glycine 0 CA--C 1.506 -0.516 0 N-CA-C 109.191 -1.563 . . . . 0.0 109.191 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -151.22 151.25 31.61 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.883 1.673 . . . . 0.0 106.868 -176.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -104.28 116.2 47.63 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.971 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -176.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -78.49 161.09 27.32 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.528 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.422 ' O ' HG13 ' A' ' 142' ' ' VAL . 81.8 t80 -55.58 -45.24 77.41 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 123.165 0.586 . . . . 0.0 112.045 -177.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.41 ' O ' HG23 ' A' ' 142' ' ' VAL . 38.2 mm-40 -66.91 -21.47 65.99 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -84.32 -38.09 20.81 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 175.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -74.5 -25.03 59.1 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.681 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.422 HG13 ' O ' ' A' ' 138' ' ' TYR . 35.1 m -56.42 -27.94 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-O 121.116 0.484 . . . . 0.0 110.623 176.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -78.11 -64.3 1.19 Allowed 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 176.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.488 ' HA ' ' O ' ' A' ' 147' ' ' ALA . 16.2 tpt -57.36 -28.72 63.41 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -171.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -57.13 -51.81 67.82 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.324 0.583 . . . . 0.0 110.028 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 19.8 m -99.82 -38.73 8.53 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.657 -177.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . 0.488 ' O ' ' HA ' ' A' ' 144' ' ' MET . . . -94.44 104.42 16.38 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 43.9 mttp . . . . . 0 C--N 1.296 -1.732 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.044 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' SER . . . . . 0.428 ' H2 ' ' CD ' ' A' ' 123' ' ' GLU . 40.7 m . . . . . 0 CA--C 1.556 1.181 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -100.58 13.81 0.46 Allowed 'Trans proline' 0 C--N 1.375 1.965 0 CA-C-N 121.338 1.513 . . . . 0.0 112.86 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' B' ' 81' ' ' PHE . . . -97.66 -33.21 11.4 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.003 -176.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . 0.464 ' HA ' ' CG ' ' B' ' 81' ' ' PHE . 30.8 p-10 -75.95 -11.07 59.89 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.381 0.61 . . . . 0.0 110.685 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 12.6 m -70.13 -44.0 69.81 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.874 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -143.96 141.53 30.24 Favored 'General case' 0 CA--C 1.515 -0.389 0 O-C-N 122.056 -0.403 . . . . 0.0 110.566 -176.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 46.5 t60 71.2 3.75 4.78 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.359 1.064 . . . . 0.0 112.205 173.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' PHE . . . . . 0.464 ' CG ' ' HA ' ' B' ' 77' ' ' ASN . 67.8 t80 -75.6 -30.5 59.6 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.6 0.714 . . . . 0.0 109.995 -177.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -60.47 -49.17 78.61 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.66 -1.155 . . . . 0.0 109.23 175.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -71.34 -27.26 63.25 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.601 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.53 -53.45 54.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.965 179.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.401 ' CZ2' ' HB3' ' A' ' 124' ' ' MET . 32.2 m95 -67.36 -35.61 79.71 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 177.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -52.41 -55.37 22.23 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.181 0.925 . . . . 0.0 108.636 177.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -68.17 -38.56 82.21 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-N 114.129 -1.396 . . . . 0.0 112.581 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.35 -50.41 71.58 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -176.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 27.3 pt -72.9 -19.72 18.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.516 0.674 . . . . 0.0 112.456 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -79.16 -49.67 12.21 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-O 121.981 0.896 . . . . 0.0 109.535 175.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . 0.542 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 18.5 tptm -71.39 -53.97 12.28 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 125.939 1.696 . . . . 0.0 113.596 -175.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . 0.511 ' HA ' HD13 ' A' ' 112' ' ' LEU . . . -54.27 -51.92 63.02 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -169.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -78.91 3.1 17.98 Favored 'General case' 0 N--CA 1.417 -2.105 0 O-C-N 122.13 -0.356 . . . . 0.0 111.378 -177.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 54.44 65.02 1.62 Allowed 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 124.526 1.13 . . . . 0.0 108.566 -175.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 95' ' ' MET . . . . . 0.619 ' SD ' ' HD2' ' A' ' 75' ' ' LYS . 13.1 ttt -74.46 -66.19 0.49 Allowed Pre-proline 0 N--CA 1.438 -1.053 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.028 -179.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.726 ' HA ' ' SD ' ' A' ' 51' ' ' MET . 31.2 Cg_endo -104.39 -166.4 0.04 OUTLIER 'Trans proline' 0 N--CA 1.416 -3.084 0 N-CA-C 108.493 -1.387 . . . . 0.0 108.493 169.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . 0.506 ' H ' ' HD2' ' B' ' 98' ' ' PRO . 11.4 m-20 -106.81 -47.34 0.11 Allowed Pre-proline 0 C--N 1.282 -2.369 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.26 169.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . 0.506 ' HD2' ' H ' ' B' ' 97' ' ' ASP . 36.6 Cg_endo -69.29 95.22 0.51 Allowed 'Trans proline' 0 C--N 1.377 2.034 0 CA-C-N 120.825 1.33 . . . . 0.0 110.262 172.212 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . 0.435 ' CD2' ' HD3' ' B' ' 91' ' ' LYS . 5.7 m-90 -81.39 78.58 8.15 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.158 0.98 . . . . 0.0 111.37 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . 0.491 ' HB2' ' CZ ' ' A' ' 68' ' ' PHE . . . . . . . . 0 N--CA 1.4 -2.939 0 CA-C-N 114.028 -1.442 . . . . 0.0 107.562 -177.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.8 mm? . . . . . 0 N--CA 1.395 -3.203 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.461 ' O ' HG13 ' A' ' 9' ' ' ILE . 27.0 p -88.1 170.09 11.37 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 174.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -64.93 -43.82 91.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -174.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -64.89 -36.56 84.74 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.838 0.827 . . . . 0.0 108.987 178.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.431 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 6.0 tp-100 -62.39 -50.27 72.21 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.349 -1.296 . . . . 0.0 108.983 178.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 5' ' ' THR . 82.5 mt -59.14 -39.7 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.571 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.5 -34.66 77.3 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.151 0.501 . . . . 0.0 111.466 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -74.42 -36.59 63.44 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.431 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 23.7 m-85 -69.19 -31.59 70.31 Favored 'General case' 0 C--O 1.2 -1.509 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.861 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -55.43 -48.18 74.83 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 172.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.81 -58.86 6.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.37 178.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.34 -48.34 62.45 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.381 0.672 . . . . 0.0 111.117 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.428 ' HZ ' ' O ' ' A' ' 25' ' ' GLY . 64.2 t80 -56.1 -44.88 79.48 Favored 'General case' 0 C--O 1.213 -0.816 0 C-N-CA 124.312 1.045 . . . . 0.0 110.892 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.4 m -73.47 -27.44 61.4 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.723 -177.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.62 -34.07 77.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.009 0.433 . . . . 0.0 111.564 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -87.74 -36.59 17.26 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.901 176.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -76.85 87.98 3.44 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-O 122.12 0.962 . . . . 0.0 109.931 176.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.499 ' HE3' ' CG2' ' A' ' 34' ' ' THR . 61.5 mttm -68.66 -28.36 66.81 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.574 -1.193 . . . . 0.0 112.655 -175.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.539 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 23.9 m-20 -82.84 -14.12 54.92 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.541 -0.864 . . . . 0.0 110.539 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.85 44.42 97.09 Favored Glycine 0 CA--C 1.517 0.205 0 O-C-N 123.353 0.408 . . . . 0.0 112.082 -178.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.539 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 4.6 p30 -113.18 -16.45 12.57 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 120.797 0.332 . . . . 0.0 111.018 -176.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.428 ' O ' ' HZ ' ' A' ' 16' ' ' PHE . . . 102.32 4.42 50.17 Favored Glycine 0 N--CA 1.431 -1.646 0 C-N-CA 120.014 -1.088 . . . . 0.0 114.666 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.9 p -138.63 130.77 28.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 118.33 1.065 . . . . 0.0 110.769 172.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 56.6 mt -93.1 128.68 44.43 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 C-N-CA 122.371 0.269 . . . . 0.0 110.368 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 p -101.47 171.51 7.53 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 123.635 0.774 . . . . 0.0 110.149 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 47.1 p -69.19 -24.84 64.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.273 0.559 . . . . 0.0 109.907 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -57.63 -53.08 62.2 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.236 175.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -67.66 -42.8 81.59 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 114.124 -1.398 . . . . 0.0 110.723 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.1 mt -59.67 -54.19 49.25 Favored 'General case' 0 C--O 1.204 -1.303 0 O-C-N 123.767 0.667 . . . . 0.0 110.314 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.91 -27.99 69.54 Favored Glycine 0 C--N 1.313 -0.741 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.035 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.499 ' CG2' ' HE3' ' A' ' 21' ' ' LYS . 58.0 m -75.6 -43.15 49.61 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 116.941 0.371 . . . . 0.0 110.804 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.416 HG13 ' HE2' ' A' ' 21' ' ' LYS . 31.5 m -68.5 -33.98 63.0 Favored 'Isoleucine or valine' 0 C--N 1.344 0.34 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.487 178.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -65.5 -40.63 93.25 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.262 173.189 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -59.8 -48.07 83.15 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 123.137 0.575 . . . . 0.0 110.072 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.3 m -69.51 -21.1 63.7 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.305 0.574 . . . . 0.0 111.041 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.558 HD11 ' O ' ' A' ' 112' ' ' LEU . 3.4 tm? -83.05 -23.2 33.27 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.044 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.73 39.71 3.09 Favored Glycine 0 N--CA 1.433 -1.521 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.512 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -143.96 135.58 26.05 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 -121.76 84.36 43.56 Favored Pre-proline 0 C--N 1.301 -1.515 0 O-C-N 122.167 -0.333 . . . . 0.0 110.193 176.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -76.83 170.87 19.02 Favored 'Trans proline' 0 C--O 1.242 0.721 0 C-N-CA 122.475 2.117 . . . . 0.0 110.163 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.524 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 77.0 p -89.42 164.38 14.88 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.904 -177.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -57.17 -41.66 79.67 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 124.356 1.062 . . . . 0.0 108.45 176.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.92 -42.35 98.98 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.094 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.524 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 7.8 mm-40 -62.92 -47.57 82.69 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 121.211 0.529 . . . . 0.0 110.965 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.4 mt -69.7 -38.12 76.84 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.503 -176.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -64.45 -45.57 86.88 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -61.47 -44.14 97.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.404 177.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 51.3 tpp -55.63 -44.09 76.79 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.016 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.7 mt -65.02 -56.26 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.569 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.448 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.5 t30 -58.92 -23.7 61.57 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -172.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -66.5 -38.77 87.97 Favored 'General case' 0 N--CA 1.386 -3.663 0 C-N-CA 123.122 0.569 . . . . 0.0 111.679 175.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.627 HG11 ' SD ' ' A' ' 71' ' ' MET . 8.6 m -95.87 -18.79 6.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 120.838 0.351 . . . . 0.0 110.454 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.448 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 38.4 t70 -70.62 89.84 0.74 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.67 -178.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.37 -27.11 23.0 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.207 -176.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -82.23 -11.71 58.51 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.384 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.08 17.98 79.69 Favored Glycine 0 N--CA 1.434 -1.451 0 CA-C-O 119.457 -0.635 . . . . 0.0 114.228 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.0 p30 -81.39 -16.31 52.59 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.043 1.421 . . . . 0.0 111.871 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.78 4.71 58.94 Favored Glycine 0 N--CA 1.441 -0.968 0 C-N-CA 120.545 -0.836 . . . . 0.0 114.027 177.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.0 p -135.78 166.77 22.52 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 117.909 0.855 . . . . 0.0 111.198 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.3 mt -91.27 111.62 24.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -89.66 161.4 16.13 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 176.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.426 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 37.1 t80 -58.5 -50.11 89.85 Favored Pre-proline 0 CA--C 1.553 1.086 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.5 Cg_endo -49.23 -41.92 41.06 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.853 2.368 . . . . 0.0 112.479 174.003 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -70.64 -41.06 72.67 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.517 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.23 -45.0 92.31 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.729 174.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.51 -45.7 80.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.338 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.519 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 43.5 m -57.35 -54.32 48.18 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 123.618 0.574 . . . . 0.0 110.816 174.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.627 ' SD ' HG11 ' A' ' 55' ' ' VAL . 35.6 ttp -53.69 -51.72 62.32 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 123.737 0.815 . . . . 0.0 112.035 -178.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.406 ' HG2' ' CE1' ' A' ' 12' ' ' PHE . 34.2 tpp -67.74 -43.27 80.31 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.097 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.65 -28.88 69.7 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 123.726 0.641 . . . . 0.0 111.54 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 70' ' ' THR . 51.6 mtp180 -79.21 -36.39 40.23 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.177 177.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -72.79 -30.66 64.27 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 121.465 0.65 . . . . 0.0 110.809 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 56.6 ttp . . . . . 0 C--N 1.308 -1.202 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.684 -176.824 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -51.36 -50.71 58.97 Favored 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.333 0.653 . . . . 0.0 111.778 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 74' ' ' ARG . 8.2 mm-40 -60.03 -35.32 74.84 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.46 -176.291 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.44 HG21 HG12 ' A' ' 142' ' ' VAL . 30.3 mm -74.97 -45.04 43.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.732 -177.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -71.48 -35.86 70.96 Favored 'General case' 0 C--O 1.21 -1.021 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.401 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.426 ' CD ' HH21 ' A' ' 90' ' ' ARG . 5.6 mm-40 -61.91 -35.89 79.7 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.637 0.256 . . . . 0.0 111.597 175.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.431 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -68.64 -44.3 74.46 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 176.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -59.9 -41.67 92.17 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 121.317 0.579 . . . . 0.0 109.533 178.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.426 HH21 ' CD ' ' A' ' 87' ' ' GLU . 7.0 tmm_? -61.7 -36.82 82.0 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 125.356 1.462 . . . . 0.0 111.822 -178.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.464 HG11 ' O ' ' B' ' 92' ' ' ALA . 9.6 p -80.43 -19.01 12.05 Favored 'Isoleucine or valine' 0 C--O 1.248 0.982 0 CA-C-O 121.589 0.709 . . . . 0.0 111.066 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -88.06 -54.3 4.29 Favored 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 120.025 -0.67 . . . . 0.0 111.467 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -104.07 87.57 2.8 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.049 0.452 . . . . 0.0 110.373 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.407 ' N ' ' HD3' ' A' ' 94' ' ' LYS . 3.3 mppt? -80.11 -28.13 39.06 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.525 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -77.44 -13.24 59.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.127 -171.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.7 62.46 3.01 Favored Glycine 0 N--CA 1.431 -1.645 0 C-N-CA 120.091 -1.052 . . . . 0.0 111.542 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -96.7 -18.64 19.53 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 176.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.86 -5.01 85.9 Favored Glycine 0 N--CA 1.441 -1.0 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -177.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.604 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 61.1 m-85 -143.54 143.36 31.5 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 -178.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.482 ' HB ' HG13 ' A' ' 136' ' ' VAL . 6.3 mt -80.22 125.2 38.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.759 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.6 m -95.57 140.06 30.94 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.13 -40.25 97.05 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.576 0.35 . . . . 0.0 111.532 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.57 -37.06 80.06 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.05 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 67.5 tt0 -77.3 -36.83 53.79 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.662 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.9 tt -66.55 -36.8 83.56 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.443 ' HB2' HG21 ' A' ' 121' ' ' VAL . 2.7 tmt_? -62.0 -40.82 96.94 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -64.36 -44.95 89.83 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.328 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.564 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.2 p -66.51 -32.3 57.45 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.172 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.421 ' HG3' HD12 ' A' ' 116' ' ' LEU . 20.5 mmt -64.39 -40.12 95.2 Favored 'General case' 0 CA--C 1.5 -0.965 0 N-CA-C 111.89 0.329 . . . . 0.0 111.89 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.4 m -62.52 -35.85 80.72 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -74.45 -28.94 61.26 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.913 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 70.4 mt -90.64 -14.87 31.49 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 121.139 0.495 . . . . 0.0 110.25 -176.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.58 3.47 86.33 Favored Glycine 0 N--CA 1.436 -1.346 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.889 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.532 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 24.0 mm-40 -70.67 -30.46 67.06 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.981 0.39 . . . . 0.0 110.01 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 51.93 86.6 0.04 OUTLIER 'General case' 0 C--O 1.246 0.91 0 O-C-N 124.594 1.184 . . . . 0.0 112.569 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.421 HD12 ' HG3' ' A' ' 109' ' ' MET . 62.4 mt -113.05 148.8 34.43 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.217 -178.31 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 9.4 p -77.09 165.21 24.9 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.993 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.9 -40.29 97.11 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.46 -35.64 81.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.891 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.77 -55.65 16.14 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.701 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.443 HG21 ' HB2' ' A' ' 106' ' ' ARG . 15.1 m -64.16 -33.13 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.421 -178.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -63.85 -43.13 97.07 Favored 'General case' 0 CA--C 1.507 -0.68 0 C-N-CA 123.193 0.597 . . . . 0.0 109.642 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -67.36 -43.66 80.9 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.907 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.8 mtt -57.8 -48.9 78.39 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.941 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.4 mm -64.26 -43.38 97.23 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.579 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.556 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -56.24 -44.32 79.52 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 123.09 0.556 . . . . 0.0 112.182 -176.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -71.56 -31.74 67.32 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 119.924 -0.711 . . . . 0.0 110.88 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.463 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -79.5 -30.51 42.0 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.645 -178.054 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -72.47 91.91 1.42 Allowed 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 124.454 1.102 . . . . 0.0 108.07 173.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 68.2 mt -81.72 -42.41 19.27 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.786 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.274 -173.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -79.54 -12.05 59.87 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.892 -176.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.35 50.45 5.07 Favored Glycine 0 C--N 1.31 -0.911 0 C-N-CA 120.431 -0.89 . . . . 0.0 113.609 175.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -100.27 -15.54 18.02 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 122.074 0.94 . . . . 0.0 108.51 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 94.5 -0.1 65.33 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.604 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 96.2 mt-30 -142.29 140.92 32.35 Favored 'General case' 0 N--CA 1.429 -1.52 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 -178.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.482 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.6 OUTLIER -99.1 122.17 50.54 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -175.526 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.462 ' ND2' ' HG3' ' A' ' 140' ' ' GLU . 0.5 OUTLIER -85.56 171.75 11.48 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.941 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.61 ' O ' HG13 ' A' ' 142' ' ' VAL . 75.2 t80 -54.57 -47.0 73.81 Favored 'General case' 0 C--O 1.219 -0.502 0 C-N-CA 123.225 0.61 . . . . 0.0 112.325 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.76 -23.67 67.46 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.072 0.463 . . . . 0.0 112.095 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.462 ' HG3' ' ND2' ' A' ' 137' ' ' ASN . 44.5 mt-10 -86.89 -37.86 17.28 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-O 121.713 0.768 . . . . 0.0 108.977 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -70.34 -30.47 67.43 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.3 -0.864 . . . . 0.0 112.102 -179.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.61 HG13 ' O ' ' A' ' 138' ' ' TYR . 28.9 m -59.83 -35.01 57.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -76.96 -34.11 57.62 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.644 0.735 . . . . 0.0 109.41 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.463 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 92.6 mmm -76.24 -35.65 58.88 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.403 -176.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 14.6 tpt . . . . . 0 C--N 1.307 -1.26 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.354 -178.17 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 64.4 tttm . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 111.383 0.142 . . . . 0.0 111.383 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 83' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' B' ' 86' ' ' LYS . 1.6 mp0 -66.43 -41.91 88.49 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 178.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -69.8 -41.78 74.58 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.99 0.424 . . . . 0.0 110.47 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 77.3 t-105 -66.31 -22.72 66.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 122.673 1.225 . . . . 0.0 109.196 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 86' ' ' LYS . . . . . 0.544 ' O ' ' HG3' ' B' ' 90' ' ' GLN . 85.2 tttt -78.97 -63.59 1.38 Allowed 'General case' 0 C--N 1.267 -3.016 0 CA-C-N 115.049 -0.978 . . . . 0.0 108.808 174.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 87' ' ' HIS . . . . . 0.404 ' HA ' ' OE1' ' B' ' 90' ' ' GLN . 31.1 m170 -63.71 -52.14 61.87 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -170.726 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.12 -29.94 69.82 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.164 0.507 . . . . 0.0 111.126 -176.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 42.8 mm -83.14 -28.62 7.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.22 -178.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 90' ' ' GLN . . . . . 0.544 ' HG3' ' O ' ' B' ' 86' ' ' LYS . 50.7 mt-30 -62.65 -46.48 88.02 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 174.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.532 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 24.6 tptm -64.68 -25.91 68.15 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.082 -1.417 . . . . 0.0 112.164 -178.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 92' ' ' ALA . . . . . 0.464 ' O ' HG11 ' A' ' 91' ' ' VAL . . . -76.83 -10.85 59.66 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -176.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 25.3 tptp . . . . . 0 C--N 1.313 -1.006 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -172.195 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.439 ' HB3' HD11 ' A' ' 9' ' ' ILE . 8.9 tp . . . . . 0 N--CA 1.42 -1.963 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.6 p -73.17 151.47 41.5 Favored 'General case' 0 N--CA 1.424 -1.727 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.271 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -53.92 -43.12 69.47 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -173.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -70.0 -33.38 71.96 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.853 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -61.64 -48.89 78.83 Favored 'General case' 0 C--O 1.212 -0.884 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 175.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.459 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 43.3 mt -60.51 -33.66 55.25 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.683 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.601 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.428 ' O ' ' HB2' ' A' ' 13' ' ' LYS . . . -65.29 -41.05 94.53 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.534 0.683 . . . . 0.0 110.25 175.558 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -65.88 -37.78 87.04 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.355 0.598 . . . . 0.0 109.634 175.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.538 ' HZ ' ' SD ' ' A' ' 76' ' ' MET . 46.4 m-85 -69.67 -25.05 63.71 Favored 'General case' 0 C--O 1.176 -2.791 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.885 177.298 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 33.1 mmtp -60.28 -47.78 84.56 Favored 'General case' 0 C--O 1.25 1.125 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 172.214 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.55 -55.39 20.8 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.379 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.89 82.32 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.166 -0.925 . . . . 0.0 113.136 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -65.6 -45.79 81.82 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -69.14 -16.92 63.76 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.681 -177.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.48 -42.27 99.36 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 171.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.416 ' CD2' HG21 ' A' ' 35' ' ' VAL . 65.4 m-85 -81.32 -51.36 8.45 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.825 178.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -70.64 98.89 1.57 Allowed 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.801 0.81 . . . . 0.0 110.551 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mmtm -77.56 -15.82 59.01 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 114.793 -1.094 . . . . 0.0 113.366 -174.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.482 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 11.1 m-20 -95.42 -14.38 23.84 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.648 -176.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.26 40.34 87.59 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.482 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 5.5 p30 -113.12 -15.23 12.82 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -175.194 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.23 14.08 60.91 Favored Glycine 0 C--N 1.313 -0.696 0 C-N-CA 120.961 -0.637 . . . . 0.0 113.539 178.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.5 p -134.76 131.39 37.5 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 174.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.8 mt -104.72 121.34 56.45 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.3 p -92.74 171.99 8.64 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.689 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.4 HG23 HD12 ' A' ' 52' ' ' ILE . 11.7 p -59.81 -35.34 74.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.558 0.694 . . . . 0.0 109.648 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -54.43 -51.0 66.33 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.109 1.364 . . . . 0.0 110.506 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -70.84 -36.38 72.86 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.272 -175.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 85.5 mt -61.65 -51.22 69.36 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 175.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.1 -29.45 74.45 Favored Glycine 0 N--CA 1.441 -1.021 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.428 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -61.18 -53.28 58.88 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 116.975 0.388 . . . . 0.0 110.433 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.416 HG21 ' CD2' ' A' ' 19' ' ' PHE . 33.9 m -71.02 -31.54 45.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.349 -177.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.451 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 64.9 mtt -68.14 -37.74 81.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.221 177.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -65.11 -31.9 73.34 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 177.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.6 m -75.33 -13.86 60.44 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.545 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -104.57 6.14 34.35 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.167 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.02 23.14 64.32 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 116.0 -0.545 . . . . 0.0 113.524 178.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.505 ' HG3' ' HD3' ' A' ' 43' ' ' PRO . 5.4 tp-100 -120.8 131.53 54.51 Favored 'General case' 0 N--CA 1.424 -1.754 0 O-C-N 122.226 -0.573 . . . . 0.0 110.474 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -123.29 79.32 53.11 Favored Pre-proline 0 C--N 1.296 -1.737 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.505 ' HD3' ' HG3' ' A' ' 41' ' ' GLN . 31.8 Cg_exo -65.89 164.24 27.89 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 122.188 1.925 . . . . 0.0 110.84 176.212 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.436 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 46.9 p -76.75 166.02 23.94 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 -179.002 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -60.07 -36.47 77.42 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.89 -45.78 93.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.66 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.436 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 34.1 mm-40 -60.49 -43.45 96.98 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.443 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.05 -46.8 76.49 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.95 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 47.1 tp60 -68.64 -42.65 77.68 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -61.39 -42.24 98.4 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.375 0.607 . . . . 0.0 109.854 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 45.0 ttm -54.31 -46.85 72.91 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.506 177.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.4 HD12 HG23 ' A' ' 29' ' ' THR . 40.2 mt -67.54 -53.61 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.178 178.442 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.401 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 12.7 t30 -54.99 -27.54 44.98 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -172.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -66.65 -42.3 86.87 Favored 'General case' 0 N--CA 1.386 -3.658 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 178.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.458 HG11 ' SD ' ' A' ' 71' ' ' MET . 4.3 m -94.82 -14.59 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-O 120.863 0.363 . . . . 0.0 111.321 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.401 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 54.0 t0 -69.28 104.83 2.33 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.54 -35.61 22.74 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.364 -173.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -91.01 -10.55 41.86 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.593 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.65 52.21 36.06 Favored Glycine 0 C--O 1.239 0.429 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.768 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -107.69 -13.89 14.93 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.537 0.208 . . . . 0.0 111.452 -178.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.9 -3.27 33.79 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.239 -0.982 . . . . 0.0 113.563 179.023 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.9 p -127.83 151.25 49.28 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 117.504 0.652 . . . . 0.0 110.84 178.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.1 mt -91.58 104.69 15.78 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.086 0 N-CA-C 104.198 -2.519 . . . . 0.0 104.198 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.13 158.82 20.29 Favored 'General case' 0 C--N 1.283 -2.303 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -175.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.426 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 52.0 t80 -51.46 -51.69 66.85 Favored Pre-proline 0 CA--C 1.554 1.122 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -176.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.41 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 8.5 Cg_endo -50.52 -44.57 39.18 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.774 2.316 . . . . 0.0 112.838 175.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -69.04 -36.94 78.27 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.537 0.684 . . . . 0.0 110.304 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -63.54 -39.64 94.94 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.092 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 87.2 mt -65.86 -44.02 86.67 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.141 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 93.2 m -54.99 -49.12 72.27 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 123.867 0.73 . . . . 0.0 109.656 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.458 ' SD ' HG11 ' A' ' 55' ' ' VAL . 17.9 ttp -54.41 -52.76 60.71 Favored 'General case' 0 C--O 1.199 -1.591 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.861 176.05 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.0 mmt -64.23 -42.67 96.46 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -174.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.39 -35.25 71.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.625 0.726 . . . . 0.0 110.486 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 -83.8 -32.79 25.16 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.126 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -83.29 -35.57 25.17 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 123.077 0.551 . . . . 0.0 112.22 -168.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.538 ' SD ' ' HZ ' ' A' ' 12' ' ' PHE . 63.6 mtm . . . . . 0 C--N 1.308 -1.226 0 CA-C-O 121.489 0.662 . . . . 0.0 110.542 -178.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 . . . . . 0 N--CA 1.467 0.398 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -64.73 -27.45 68.92 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 121.056 0.455 . . . . 0.0 111.542 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.66 -27.25 55.54 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.858 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 27.2 mm -72.32 -38.61 61.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 174.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -61.74 -42.77 99.4 Favored 'General case' 0 C--O 1.21 -0.996 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.296 174.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -56.33 -51.75 67.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.432 ' HA ' HG12 ' A' ' 91' ' ' VAL . . . -59.04 -43.64 91.68 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.197 179.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.36 -54.02 49.18 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.68 -43.67 69.09 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 125.166 1.386 . . . . 0.0 112.707 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.432 HG12 ' HA ' ' A' ' 88' ' ' ALA . 11.9 p -72.15 -25.94 24.28 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.536 -176.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -82.06 -56.07 4.18 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 175.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -84.23 85.07 7.41 Favored 'General case' 0 C--O 1.252 1.212 0 CA-C-O 122.124 0.964 . . . . 0.0 110.663 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -78.65 -35.02 45.97 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 114.447 -1.251 . . . . 0.0 112.798 -178.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -73.32 -13.57 61.14 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 121.186 0.517 . . . . 0.0 111.003 -178.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.63 52.6 9.62 Favored Glycine 0 N--CA 1.43 -1.715 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -87.94 -18.62 28.72 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.22 6.07 88.34 Favored Glycine 0 CA--C 1.501 -0.805 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.558 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 98.5 m-85 -147.34 149.85 33.6 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 -178.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.51 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.9 mt -93.48 123.3 45.52 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.875 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 175.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 29.9 t -104.06 151.94 22.65 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 123.723 0.809 . . . . 0.0 109.451 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.31 -34.91 79.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.776 178.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.25 86.23 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.089 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.561 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 2.1 tp10 -68.33 -41.17 81.19 Favored 'General case' 0 CA--C 1.503 -0.856 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.437 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -61.43 -39.32 90.37 Favored 'General case' 0 N--CA 1.427 -1.601 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -175.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.708 ' HG3' HG21 ' A' ' 121' ' ' VAL . 19.5 mtm180 -56.65 -42.8 79.57 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.401 172.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' HIS . . . . . 0.561 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 50.3 m170 -54.52 -56.04 22.97 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.584 0.753 . . . . 0.0 110.697 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.406 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.2 p -70.94 -35.65 60.5 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.137 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.187 -174.353 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 22.7 mmt -63.49 -45.28 91.44 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -177.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.8 p -65.23 -36.01 82.82 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-O 121.135 0.493 . . . . 0.0 110.129 176.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -66.0 -32.58 74.14 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.696 178.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 78.9 mt -85.05 -17.91 36.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.824 -177.406 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 80.33 23.84 60.16 Favored Glycine 0 N--CA 1.435 -1.414 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.451 -177.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -84.99 -35.22 22.11 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 55.4 tptt 47.58 88.25 0.02 OUTLIER 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.648 1.579 . . . . 0.0 113.611 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 64.6 mt -101.06 155.63 17.88 Favored 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 24.3 p -75.78 166.09 24.06 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 175.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -63.52 -34.14 77.14 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -64.13 -44.58 91.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.159 176.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -70.5 -35.66 73.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.855 -174.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.708 HG21 ' HG3' ' A' ' 106' ' ' ARG . 19.2 m -72.52 -33.27 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.897 176.694 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -70.94 -41.86 70.57 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.284 -177.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -68.55 -31.08 70.04 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.016 177.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.4 mtt -58.8 -48.53 80.96 Favored 'General case' 0 CA--C 1.497 -1.071 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.263 175.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.11 -46.57 96.18 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.533 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.656 178.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -55.67 -44.41 77.26 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.25 0.62 . . . . 0.0 111.48 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -66.17 -28.82 69.07 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.094 0.558 . . . . 0.0 111.37 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.478 ' HB1' HG21 ' A' ' 136' ' ' VAL . . . -97.52 -20.57 17.64 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.624 -0.431 . . . . 0.0 112.05 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.404 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 5.4 t70 -70.24 93.22 0.82 Allowed 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 124.052 0.941 . . . . 0.0 110.244 177.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.1 mt -84.53 -40.31 15.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.229 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -83.76 -10.99 57.72 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.259 0.552 . . . . 0.0 112.305 -172.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.404 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 75.64 55.75 4.87 Favored Glycine 0 C--N 1.307 -1.083 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.587 176.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -111.84 -17.08 13.02 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 177.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.32 4.62 60.94 Favored Glycine 0 N--CA 1.439 -1.136 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.558 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 96.4 mt-30 -147.76 145.12 28.69 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.51 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.0 OUTLIER -102.81 120.4 52.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -176.094 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -86.05 168.3 14.22 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.433 ' O ' HG13 ' A' ' 142' ' ' VAL . 68.2 t80 -55.62 -46.83 77.33 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.971 0.909 . . . . 0.0 112.852 -174.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.476 ' HA ' HG22 ' A' ' 142' ' ' VAL . 28.9 mm-40 -67.45 -26.61 66.48 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -178.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -73.62 -44.87 55.88 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -63.95 -38.7 92.04 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.759 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.476 HG22 ' HA ' ' A' ' 139' ' ' GLU . 15.9 m -66.85 -35.02 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.633 177.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -72.73 -37.98 67.56 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.412 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 1.5 tmt? -72.54 -50.88 22.6 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.917 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.881 0 C-N-CA 123.167 0.587 . . . . 0.0 110.548 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 84.2 tttt . . . . . 0 C--O 1.238 0.466 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -77.16 -45.08 27.94 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 175.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.73 -49.98 74.76 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.512 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -60.22 -38.14 82.47 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -63.38 -29.97 71.18 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 121.364 0.602 . . . . 0.0 110.897 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -84.12 -43.56 14.91 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.091 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.0 -56.76 18.05 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 123.732 0.813 . . . . 0.0 112.312 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 74.2 mt -62.15 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.086 0.469 . . . . 0.0 110.672 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -66.64 -36.31 82.28 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.286 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -73.16 -38.58 66.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.37 -41.2 94.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.978 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 121.079 0.466 . . . . 0.0 110.034 176.267 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.605 ' HB3' ' HB2' ' A' ' 8' ' ' GLN . 2.9 mm? . . . . . 0 N--CA 1.416 -2.156 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.437 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 25.0 p -79.96 160.89 25.78 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -62.19 -31.4 71.91 Favored 'General case' 0 C--O 1.203 -1.375 0 C-N-CA 121.218 -0.193 . . . . 0.0 110.754 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 11' ' ' GLU . 1.8 mp0 -63.41 -42.34 98.76 Favored 'General case' 0 C--N 1.314 -0.974 0 O-C-N 123.5 0.5 . . . . 0.0 111.057 177.285 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.605 ' HB2' ' HB3' ' A' ' 4' ' ' LEU . 27.6 mm-40 -64.67 -47.9 76.73 Favored 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.8 mt -56.8 -39.33 63.58 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.31 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.4 89.58 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 123.521 0.728 . . . . 0.0 111.069 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 7' ' ' GLU . 60.2 mm-40 -61.85 -44.34 97.03 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.554 0.692 . . . . 0.0 109.444 176.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -68.28 -29.76 68.62 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.444 -178.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -68.42 -33.54 74.39 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.982 175.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -68.49 -50.03 55.36 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.7 -43.09 72.2 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.771 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.41 ' HZ ' ' C ' ' A' ' 25' ' ' GLY . 70.2 t80 -59.17 -44.0 92.14 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.777 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.5 m -74.52 -20.87 59.81 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.733 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.256 2.9 tm? -68.67 -50.65 49.38 Favored 'General case' 0 CA--C 1.483 -1.63 0 N-CA-C 106.198 -1.779 . . . . 0.0 106.198 175.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.469 ' CZ ' HD23 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -77.39 -41.1 41.35 Favored 'General case' 0 N--CA 1.383 -3.809 0 CA-C-N 111.616 -2.538 . . . . 0.0 111.62 -167.87 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -69.97 96.28 1.02 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -74.13 -36.95 64.22 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.192 -0.913 . . . . 0.0 113.291 -174.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -93.08 -13.57 28.4 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.231 -177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.07 57.4 8.64 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 121.313 -0.47 . . . . 0.0 113.593 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -113.74 -11.96 12.84 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 116.913 0.356 . . . . 0.0 111.053 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.41 ' C ' ' HZ ' ' A' ' 16' ' ' PHE . . . 102.66 5.75 47.73 Favored Glycine 0 N--CA 1.43 -1.704 0 C-N-CA 119.833 -1.175 . . . . 0.0 113.118 -178.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.434 HG22 ' HA ' ' A' ' 64' ' ' ASP . 24.0 p -145.57 156.39 43.66 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 117.721 0.761 . . . . 0.0 111.011 173.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 72.5 mt -107.56 109.12 27.04 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.6 p -84.96 167.93 15.44 Favored 'General case' 0 C--N 1.288 -2.072 0 O-C-N 122.202 -0.312 . . . . 0.0 110.962 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -56.56 -34.36 67.03 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 123.304 0.642 . . . . 0.0 111.226 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -59.65 -42.15 92.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.819 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -70.25 -33.31 71.46 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.933 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.568 HD11 HG13 ' A' ' 52' ' ' ILE . 65.2 mt -56.25 -59.73 4.52 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 174.035 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.14 -26.8 64.1 Favored Glycine 0 C--O 1.19 -2.652 0 CA-C-N 114.599 -1.182 . . . . 0.0 112.968 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.4 m -65.24 -53.55 42.66 Favored 'General case' 0 CA--C 1.558 1.286 0 CA-C-N 117.734 0.767 . . . . 0.0 110.705 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.1 m -72.27 -32.56 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.32 0.581 . . . . 0.0 109.861 -178.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.421 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 66.9 mtp -72.33 -29.24 63.64 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.589 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -68.15 -36.12 79.15 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 175.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -63.43 -27.46 69.3 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.02 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.565 HD11 ' HD2' ' B' ' 91' ' ' LYS . 4.6 mm? -85.51 -13.54 48.71 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.105 0.478 . . . . 0.0 111.052 177.277 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.14 16.81 36.74 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.153 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -106.16 130.56 54.02 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -124.38 83.99 56.84 Favored Pre-proline 0 C--N 1.3 -1.545 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.965 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.559 ' HG2' HD21 ' A' ' 48' ' ' LEU . 6.2 Cg_endo -85.73 164.55 10.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.46 2.107 . . . . 0.0 111.117 173.711 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.0 p -86.9 169.13 12.78 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 120.932 0.396 . . . . 0.0 111.349 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -58.71 -45.58 89.24 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 125.275 1.43 . . . . 0.0 110.229 -176.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.88 95.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.512 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.435 ' O ' ' HG3' ' A' ' 51' ' ' MET . 40.0 mt-10 -61.67 -47.22 86.34 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.006 0.432 . . . . 0.0 110.128 178.32 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.559 HD21 ' HG2' ' A' ' 43' ' ' PRO . 95.8 mt -64.82 -38.39 90.82 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.755 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -61.1 -46.05 92.21 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.993 176.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -62.8 -39.93 95.79 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 123.37 0.419 . . . . 0.0 111.241 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.435 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 67.9 mtt -60.78 -45.76 93.11 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.024 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.568 HG13 HD11 ' A' ' 32' ' ' LEU . 23.4 mt -73.48 -36.81 49.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.77 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.403 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.6 t30 -57.9 -22.46 48.58 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 123.086 0.554 . . . . 0.0 112.346 -176.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -64.09 -32.82 74.52 Favored 'General case' 0 N--CA 1.386 -3.651 0 C-N-CA 124.261 1.024 . . . . 0.0 111.398 176.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.482 ' CG1' ' HB2' ' A' ' 71' ' ' MET . 10.9 m -107.53 -22.81 4.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-O 121.259 0.552 . . . . 0.0 110.086 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.475 ' HB2' HG22 ' A' ' 52' ' ' ILE . 42.3 t0 -73.08 116.02 13.11 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.48 -174.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.4 -16.07 38.38 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.673 177.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -88.88 -11.08 45.65 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.081 -175.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 56.32 29.79 57.29 Favored Glycine 0 CA--C 1.525 0.664 0 CA-C-N 115.479 -0.782 . . . . 0.0 113.354 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 37.2 p30 -116.33 -12.8 11.07 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 108.78 24.69 5.98 Favored Glycine 0 N--CA 1.44 -1.068 0 C-N-CA 119.489 -1.339 . . . . 0.0 113.582 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.3 p -120.24 131.6 55.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 117.581 0.691 . . . . 0.0 111.814 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.9 mt -94.67 110.21 23.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 170.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.434 ' HA ' HG22 ' A' ' 26' ' ' THR . 5.1 m-20 -90.98 158.01 16.96 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 178.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.435 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 21.9 t80 -55.8 -47.84 97.86 Favored Pre-proline 0 CA--C 1.555 1.172 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -176.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.435 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.5 Cg_endo -50.28 -44.6 37.92 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.607 2.205 . . . . 0.0 112.173 172.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -67.08 -42.3 84.88 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.752 0.421 . . . . 0.0 110.219 -179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.51 -50.41 71.88 Favored 'General case' 0 C--O 1.244 0.79 0 C-N-CA 124.358 1.063 . . . . 0.0 109.55 176.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.4 mt -61.04 -40.75 94.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.764 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.0 m -59.26 -48.01 83.22 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.566 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.482 ' HB2' ' CG1' ' A' ' 55' ' ' VAL . 29.9 ttp -57.89 -49.99 74.84 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.938 178.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 24.4 mmt -67.39 -43.42 81.39 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 120.252 -0.579 . . . . 0.0 112.43 -176.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.48 -31.36 70.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.041 0.448 . . . . 0.0 111.216 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -80.75 -40.89 24.41 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-O 121.023 0.439 . . . . 0.0 110.871 176.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -77.99 -38.07 45.8 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.146 0.498 . . . . 0.0 110.444 -169.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 46.7 mtm . . . . . 0 C--N 1.318 -0.761 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.048 -179.488 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.437 -1.081 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -64.35 -42.48 96.22 Favored 'General case' 0 CA--C 1.507 -0.691 0 C-N-CA 120.074 -0.65 . . . . 0.0 110.126 172.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -58.07 -40.11 80.22 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.887 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 44.9 mm -67.4 -44.51 86.93 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.172 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -71.7 -39.78 69.96 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.491 -178.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -64.82 -40.66 95.56 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 120.827 0.346 . . . . 0.0 110.876 177.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.466 ' HB1' HD12 ' B' ' 89' ' ' ILE . . . -68.02 -35.94 79.13 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.241 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -65.62 -48.58 71.75 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -55.42 -32.63 62.84 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 179.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 13.8 p -74.62 -28.84 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.334 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.439 ' O ' ' HG2' ' A' ' 104' ' ' GLU . 88.3 m-85 -89.19 -35.56 16.15 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.417 0.627 . . . . 0.0 110.23 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -88.82 69.31 8.63 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 174.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -66.6 -34.51 78.04 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 113.821 -1.536 . . . . 0.0 112.771 -171.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -90.22 -7.18 54.18 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.422 0.629 . . . . 0.0 110.476 -176.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.06 55.91 6.78 Favored Glycine 0 CA--C 1.502 -0.764 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -104.19 -18.59 14.44 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.973 0.416 . . . . 0.0 110.181 -175.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.9 10.56 66.58 Favored Glycine 0 N--CA 1.436 -1.36 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.036 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -156.32 141.49 17.38 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 120.851 0.357 . . . . 0.0 110.739 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.487 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.1 mt -97.49 137.02 26.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.241 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 61.9 p -114.99 158.16 22.44 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.496 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.405 ' HB1' HG23 ' A' ' 121' ' ' VAL . . . -66.45 -34.84 78.84 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 121.075 0.464 . . . . 0.0 109.879 178.121 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.89 -52.01 67.27 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.859 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.697 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 41.1 tp10 -65.61 -43.3 90.03 Favored 'General case' 0 CA--C 1.482 -1.636 0 C-N-CA 120.424 -0.51 . . . . 0.0 111.554 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.488 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.1 tt -57.38 -39.28 75.72 Favored 'General case' 0 N--CA 1.423 -1.814 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 -173.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.615 ' HG3' HG21 ' A' ' 121' ' ' VAL . 52.8 mtp180 -65.77 -34.66 78.69 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 173.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' HIS . . . . . 0.697 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 30.7 m170 -58.98 -55.57 33.46 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.669 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -64.81 -37.74 80.95 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.392 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.732 -176.32 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.488 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.2 mmt -60.3 -37.94 82.12 Favored 'General case' 0 C--O 1.251 1.149 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 65.1 m -62.25 -40.58 96.67 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.18 177.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.95 -17.06 53.94 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.251 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.669 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 97.2 mt -92.18 -14.1 29.59 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 121.2 0.524 . . . . 0.0 111.83 -176.094 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 82.2 6.1 89.08 Favored Glycine 0 N--CA 1.437 -1.274 0 C-N-CA 120.272 -0.966 . . . . 0.0 111.418 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.41 ' HB2' ' SD ' ' A' ' 109' ' ' MET . 47.2 mm-40 -73.2 -44.08 60.33 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 67.1 mttm 57.58 90.74 0.04 OUTLIER 'General case' 0 C--O 1.242 0.668 0 O-C-N 124.763 1.29 . . . . 0.0 111.026 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.427 HD22 ' HG2' ' A' ' 120' ' ' GLU . 76.4 mt -125.89 131.28 52.38 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 -178.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 17.5 p -83.05 176.89 8.88 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.638 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -60.22 -27.74 67.44 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -172.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -68.75 -51.3 42.67 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 118.825 0.739 . . . . 0.0 111.011 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.427 ' HG2' HD22 ' A' ' 116' ' ' LEU . 7.2 tp10 -58.19 -49.78 75.83 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.945 -177.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.615 HG21 ' HG3' ' A' ' 106' ' ' ARG . 4.3 m -69.99 -29.03 38.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.845 -176.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -65.08 -46.95 79.02 Favored 'General case' 0 CA--C 1.485 -1.52 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -63.17 -36.73 84.59 Favored 'General case' 0 N--CA 1.443 -0.79 0 O-C-N 124.157 0.911 . . . . 0.0 109.79 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.9 mtt -59.88 -49.83 76.16 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.14 176.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 47.3 mm -69.03 -54.0 22.7 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.47 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.29 -178.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -57.15 -41.2 78.69 Favored 'General case' 0 C--N 1.309 -1.167 0 C-N-CA 124.806 1.242 . . . . 0.0 112.802 -172.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -81.87 -21.82 37.25 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.925 -0.71 . . . . 0.0 111.698 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -80.08 -36.45 35.5 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 176.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -61.83 104.44 0.45 Allowed 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 125.707 1.603 . . . . 0.0 109.221 175.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 72.1 mt -83.28 -45.25 18.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.65 -175.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -82.26 -11.01 58.91 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.879 -0.601 . . . . 0.0 112.29 -170.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.18 53.95 3.73 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.718 177.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -115.68 -17.59 11.06 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 121.566 0.698 . . . . 0.0 110.435 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.86 9.85 62.07 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -144.95 125.97 14.53 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.487 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.0 OUTLIER -90.56 117.9 34.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 123.455 0.472 . . . . 0.0 111.702 -178.362 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -84.79 175.66 9.01 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.5 178.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.541 ' O ' HG13 ' A' ' 142' ' ' VAL . 84.2 t80 -62.3 -43.26 99.24 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.709 -177.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -63.77 -21.99 66.69 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -87.78 -35.62 17.76 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -72.98 -36.66 67.13 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.72 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.541 HG13 ' O ' ' A' ' 138' ' ' TYR . 33.8 m -59.48 -35.44 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-O 120.995 0.426 . . . . 0.0 111.7 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -70.51 -29.62 66.18 Favored 'General case' 0 C--O 1.205 -1.241 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.977 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 73.2 mtp -57.78 -40.38 79.71 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.794 0.438 . . . . 0.0 112.09 -177.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 51.8 tpp . . . . . 0 C--N 1.321 -0.669 0 CA-C-O 121.22 0.533 . . . . 0.0 110.555 -178.831 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 95.3 mttt . . . . . 0 N--CA 1.442 -0.863 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -82.42 -37.22 25.81 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.96 -47.55 85.91 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.728 0.642 . . . . 0.0 109.679 176.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.643 ' O ' HG12 ' B' ' 89' ' ' ILE . 38.8 m95 -63.71 -43.12 97.53 Favored 'General case' 0 C--O 1.199 -1.573 0 CA-C-O 119.415 -0.326 . . . . 0.0 111.486 175.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -53.09 -51.75 60.82 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.87 0.843 . . . . 0.0 109.191 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -58.24 -45.66 87.35 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 113.43 -1.714 . . . . 0.0 109.595 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.25 -49.4 75.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.13 178.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.643 HG12 ' O ' ' B' ' 85' ' ' TRP . 51.8 mm -57.71 -51.44 70.17 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.468 0 C-N-CA 123.347 0.659 . . . . 0.0 109.312 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -61.8 -28.94 69.82 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.239 -177.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.565 ' HD2' HD11 ' A' ' 39' ' ' LEU . 4.5 tppp? -81.71 -53.29 6.34 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 120.983 0.421 . . . . 0.0 110.975 175.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.93 -44.89 68.69 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -174.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp . . . . . 0 C--N 1.317 -0.831 0 CA-C-O 121.801 0.81 . . . . 0.0 110.222 -175.061 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.448 ' HB3' HD11 ' A' ' 9' ' ' ILE . 14.4 tp . . . . . 0 N--CA 1.422 -1.861 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.41 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 10.0 p -68.15 142.87 55.61 Favored 'General case' 0 N--CA 1.424 -1.726 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.632 178.6 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -59.18 -33.29 70.77 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 123.936 0.894 . . . . 0.0 112.481 -171.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 34.2 tt0 -66.38 -41.5 89.32 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.23 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.41 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 64.3 mm-40 -67.69 -40.66 84.35 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.576 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 63.5 mt -58.12 -41.38 80.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.926 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.49 95.53 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 121.51 0.671 . . . . 0.0 110.921 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 7' ' ' GLU . 30.3 mt-10 -69.89 -30.96 68.52 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.727 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -75.71 -23.77 56.13 Favored 'General case' 0 C--O 1.189 -2.1 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.979 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.576 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -63.38 -46.75 85.03 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 120.838 0.351 . . . . 0.0 110.762 176.229 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -68.34 -40.06 81.71 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.132 -0.627 . . . . 0.0 111.529 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.04 -38.91 89.56 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-O 121.226 0.536 . . . . 0.0 109.803 178.507 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -60.06 -46.57 89.1 Favored 'General case' 0 C--O 1.2 -1.548 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.982 176.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.1 m -69.36 -17.2 63.66 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.374 -178.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.72 -33.48 64.38 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 176.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.553 ' CD2' HG21 ' A' ' 35' ' ' VAL . 20.4 m-85 -89.86 -38.61 13.62 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.821 178.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -80.79 97.93 7.56 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 176.191 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -75.1 -6.92 52.08 Favored 'General case' 0 C--N 1.288 -2.076 0 CA-C-N 115.265 -0.879 . . . . 0.0 113.223 -176.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.428 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 18.9 m-20 -102.67 -14.53 16.66 Favored 'General case' 0 C--O 1.244 0.778 0 C-N-CA 119.379 -0.928 . . . . 0.0 109.38 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.78 45.92 94.21 Favored Glycine 0 C--N 1.339 0.722 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -175.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.428 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 2.7 p30 -113.3 -16.24 12.54 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -173.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.23 4.79 50.25 Favored Glycine 0 C--N 1.309 -0.935 0 C-N-CA 121.149 -0.548 . . . . 0.0 113.355 178.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 79.9 p -132.92 139.32 47.29 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 117.458 0.629 . . . . 0.0 109.63 173.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.9 mt -112.04 129.82 66.82 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.8 p -99.28 174.58 6.23 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.908 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.4 p -66.18 -31.25 71.97 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 121.611 0.72 . . . . 0.0 109.866 176.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -61.56 -50.62 71.91 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.439 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.32 -42.91 92.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.817 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.0 mt -56.78 -53.37 58.56 Favored 'General case' 0 C--O 1.22 -0.452 0 O-C-N 123.573 0.546 . . . . 0.0 111.273 177.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.74 -37.43 94.35 Favored Glycine 0 C--O 1.226 -0.364 0 C-N-CA 120.201 -0.999 . . . . 0.0 112.837 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 70.3 m -62.69 -46.19 89.27 Favored 'General case' 0 C--O 1.25 1.114 0 CA-C-N 116.948 0.374 . . . . 0.0 111.339 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.553 HG21 ' CD2' ' A' ' 19' ' ' PHE . 32.9 m -71.17 -34.05 53.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 C-N-CA 120.164 -0.614 . . . . 0.0 110.56 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.645 ' HB3' ' O ' ' A' ' 41' ' ' GLN . 62.1 mtt -66.99 -36.04 81.28 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.418 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -62.34 -41.31 98.47 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.288 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.9 m -67.68 -27.4 66.81 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.998 176.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 97.4 mt -82.47 -10.5 59.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.803 0.335 . . . . 0.0 111.125 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.83 24.65 48.6 Favored Glycine 0 N--CA 1.439 -1.148 0 C-N-CA 121.169 -0.539 . . . . 0.0 112.815 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.645 ' O ' ' HB3' ' A' ' 36' ' ' MET . 48.5 tt0 -155.23 100.26 2.14 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -122.26 92.59 48.89 Favored Pre-proline 0 C--N 1.304 -1.402 0 C-N-CA 119.265 -0.974 . . . . 0.0 113.443 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.557 ' HD2' ' SD ' ' A' ' 36' ' ' MET . 50.2 Cg_exo -56.8 161.62 9.97 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 123.404 2.736 . . . . 0.0 111.695 171.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.484 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 19.1 p -74.6 160.25 31.1 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -176.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -51.9 -44.45 63.8 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 124.175 0.99 . . . . 0.0 112.613 -177.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.69 76.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.062 0.458 . . . . 0.0 110.962 -178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 51' ' ' MET . 39.9 mm-40 -72.78 -42.75 63.61 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.45 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 44' ' ' THR . 79.2 mt -62.63 -39.53 94.14 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.549 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.9 tp60 -67.22 -35.15 78.99 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.732 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.19 -39.17 78.84 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 123.285 0.366 . . . . 0.0 110.128 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.461 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 61.5 mtt -57.09 -47.31 81.34 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.027 174.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.9 mt -59.45 -50.35 80.24 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.247 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.445 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 12.1 t30 -63.04 -15.69 57.34 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -173.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -71.16 -39.24 72.05 Favored 'General case' 0 N--CA 1.384 -3.732 0 O-C-N 121.759 -0.588 . . . . 0.0 110.275 175.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.409 HG11 ' SD ' ' A' ' 71' ' ' MET . 26.0 m -99.57 -20.69 5.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.307 -177.172 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.445 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 46.7 t0 -68.04 99.3 0.85 Allowed 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.258 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.45 -29.68 22.63 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.799 -173.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -91.03 -9.79 44.56 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.967 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.94 46.77 70.49 Favored Glycine 0 N--CA 1.441 -0.987 0 CA-C-N 115.399 -0.819 . . . . 0.0 113.255 174.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -101.91 -9.43 20.7 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.308 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.84 -6.3 43.89 Favored Glycine 0 N--CA 1.44 -1.053 0 C-N-CA 120.537 -0.839 . . . . 0.0 113.596 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.8 p -130.01 161.71 30.34 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-N 117.489 0.645 . . . . 0.0 110.991 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 26' ' ' THR . 29.1 mt -99.05 119.37 46.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.435 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.576 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 7.4 t0 -89.27 161.72 16.24 Favored 'General case' 0 C--N 1.292 -1.922 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.296 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.407 ' CZ ' HD21 ' A' ' 69' ' ' LEU . 54.7 t80 -53.53 -53.58 55.28 Favored Pre-proline 0 CA--C 1.569 1.702 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -176.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.576 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 8.7 Cg_endo -50.76 -38.45 56.65 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 123.224 2.616 . . . . 0.0 113.603 174.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -69.62 -37.43 76.83 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.796 0.808 . . . . 0.0 109.688 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -67.63 -39.07 84.66 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.327 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.407 HD21 ' CZ ' ' A' ' 65' ' ' PHE . 78.2 mt -62.68 -39.72 94.87 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.492 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.7 m -56.07 -48.34 76.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.301 0.572 . . . . 0.0 109.634 176.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.409 ' SD ' HG11 ' A' ' 55' ' ' VAL . 28.3 ttp -60.67 -42.47 97.15 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.596 179.134 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.404 ' O ' ' HB3' ' A' ' 75' ' ' LYS . 20.9 mmt -73.98 -36.18 64.53 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.078 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.26 -41.05 97.12 Favored 'General case' 0 C--O 1.21 -1.005 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 175.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -63.06 -30.03 71.28 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.346 175.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 72' ' ' MET . 37.3 ttmt -63.78 -41.03 98.03 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 121.151 0.5 . . . . 0.0 109.934 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.5 mtm . . . . . 0 C--N 1.31 -1.126 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.564 -177.208 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 . . . . . 0 C--O 1.215 -0.74 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.637 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 2.2 mp0 -46.87 -57.31 5.06 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 125.757 1.623 . . . . 0.0 110.348 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.59 -45.87 70.86 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.421 -175.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.8 mm -73.67 -35.7 44.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 120.704 0.287 . . . . 0.0 111.393 -174.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -74.68 -32.42 62.2 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -62.04 -45.45 93.51 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 176.064 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.401 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -67.02 -38.66 86.34 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 113.964 -1.471 . . . . 0.0 111.261 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -66.4 -41.67 88.98 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -53.87 -40.46 66.56 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 111.284 177.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 88' ' ' ALA . 11.6 p -75.58 -29.2 20.5 Favored 'Isoleucine or valine' 0 C--O 1.246 0.911 0 CA-C-O 120.917 0.389 . . . . 0.0 111.188 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -77.32 -62.71 1.57 Allowed 'General case' 0 C--O 1.21 -1.008 0 C-N-CA 119.689 -0.805 . . . . 0.0 111.084 178.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -85.84 94.75 9.23 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.764 0.792 . . . . 0.0 111.704 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.49 ' HZ1' ' HB ' ' A' ' 108' ' ' VAL . 43.0 mttp -80.44 -17.47 51.64 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 114.912 -1.04 . . . . 0.0 113.367 -178.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -92.65 -12.23 32.12 Favored 'General case' 0 CA--C 1.499 -0.994 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -176.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.95 44.54 30.08 Favored Glycine 0 N--CA 1.444 -0.785 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -93.43 -18.48 22.29 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.0 17.32 74.91 Favored Glycine 0 C--O 1.241 0.537 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.539 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 79.3 m-85 -150.0 152.61 35.18 Favored 'General case' 0 N--CA 1.437 -1.1 0 C-N-CA 124.617 1.167 . . . . 0.0 108.437 -177.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.491 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.3 mt -109.61 131.67 59.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.303 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 174.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.5 p -110.32 156.33 20.88 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.19 -41.58 97.07 Favored 'General case' 0 C--O 1.212 -0.882 0 C-N-CA 122.685 0.394 . . . . 0.0 111.504 -178.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.62 -49.14 78.9 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 123.16 0.287 . . . . 0.0 111.035 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -56.44 -52.41 64.78 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.899 0.857 . . . . 0.0 109.7 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.487 ' O ' ' HG2' ' A' ' 109' ' ' MET . 8.0 tt -63.54 -40.52 97.21 Favored 'General case' 0 N--CA 1.413 -2.306 0 CA-C-N 113.941 -1.482 . . . . 0.0 110.192 -172.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -61.11 -43.1 99.4 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -68.98 -37.52 78.8 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.002 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.59 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.1 p -66.32 -29.89 48.09 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.265 0 C-N-CA 119.497 -0.881 . . . . 0.0 109.623 177.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.487 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.4 mmt -60.52 -40.11 90.26 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-O 120.646 0.26 . . . . 0.0 110.593 176.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.3 m -60.83 -40.23 92.0 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.936 175.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -75.4 -17.27 60.24 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.808 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 68.4 mt -98.93 -20.61 16.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.994 0.426 . . . . 0.0 110.857 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.41 11.62 47.56 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.642 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -89.18 137.11 32.62 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -177.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -118.21 90.98 3.45 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-O 121.495 0.664 . . . . 0.0 110.258 177.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 75.9 mt -110.95 167.0 10.58 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 28.7 p -100.7 172.54 7.02 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.8 -24.94 67.96 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -67.87 -40.1 83.63 Favored 'General case' 0 N--CA 1.428 -1.547 0 C-N-CA 123.046 0.538 . . . . 0.0 110.784 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -75.49 -42.94 51.6 Favored 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 121.811 -0.556 . . . . 0.0 111.996 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 125' ' ' ILE . 14.1 m -68.39 -29.58 44.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 C-N-CA 120.285 -0.566 . . . . 0.0 109.913 -178.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -70.67 -43.67 68.64 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.324 176.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -64.2 -35.11 79.72 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.469 ' HE3' ' HB1' ' B' ' 84' ' ' ALA . 62.8 mtt -54.15 -51.26 64.85 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.151 175.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.5 mm -69.11 -59.72 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.226 -177.046 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -61.82 -33.53 74.3 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 -170.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -81.08 -24.39 37.81 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 119.985 -0.686 . . . . 0.0 110.673 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.705 ' HA ' ' SD ' ' A' ' 144' ' ' MET . . . -91.93 -12.85 32.31 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 122.375 1.083 . . . . 0.0 109.768 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -78.82 72.77 5.36 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 122.819 1.295 . . . . 0.0 110.286 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.414 ' HB ' ' OE1' ' A' ' 140' ' ' GLU . 35.7 mt -82.79 -12.26 12.13 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 CA-C-N 114.291 -1.322 . . . . 0.0 107.938 174.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -79.92 -10.42 59.77 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.81 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.64 40.62 99.39 Favored Glycine 0 N--CA 1.442 -0.964 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.744 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -112.34 -16.42 12.95 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.319 0.581 . . . . 0.0 110.142 -177.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 90.99 14.32 57.91 Favored Glycine 0 C--O 1.25 1.147 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 -177.118 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.539 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 26.0 mt-30 -150.11 139.49 21.4 Favored 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 124.699 1.2 . . . . 0.0 107.791 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.491 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.2 p -76.23 123.99 33.54 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.139 0.495 . . . . 0.0 110.977 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -91.71 154.08 19.22 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.546 ' O ' HG13 ' A' ' 142' ' ' VAL . 82.8 t80 -57.95 -48.99 78.32 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 124.328 1.051 . . . . 0.0 110.151 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -66.71 -22.14 66.07 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.414 ' OE1' ' HB ' ' A' ' 130' ' ' ILE . 29.0 mm-40 -87.32 -37.52 17.06 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -69.21 -35.03 75.78 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.295 -178.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.546 HG13 ' O ' ' A' ' 138' ' ' TYR . 22.2 m -65.19 -31.31 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 121.173 0.511 . . . . 0.0 110.066 177.135 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -70.83 -48.55 53.43 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.705 ' SD ' ' HA ' ' A' ' 128' ' ' ALA . 82.7 mtp -66.59 -15.82 63.72 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.328 -178.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 57.3 tpp . . . . . 0 C--N 1.312 -1.022 0 CA-C-O 120.818 0.342 . . . . 0.0 110.199 177.397 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 82' ' ' LYS . . . . . 0.545 ' O ' ' HB2' ' B' ' 86' ' ' LYS . 64.1 tttp . . . . . 0 N--CA 1.452 -0.37 0 CA-C-O 120.62 0.248 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -76.82 -27.64 55.24 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-O 121.104 0.478 . . . . 0.0 110.595 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.469 ' HB1' ' HE3' ' A' ' 124' ' ' MET . . . -62.61 -61.35 2.49 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.582 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.548 ' O ' HG12 ' B' ' 89' ' ' ILE . 57.2 m95 -64.62 -31.05 72.1 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 86' ' ' LYS . . . . . 0.545 ' HB2' ' O ' ' B' ' 82' ' ' LYS . 78.8 tttt -52.98 -50.02 64.99 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 124.454 1.102 . . . . 0.0 109.866 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -76.38 -41.17 48.92 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.461 177.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 88' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' B' ' 85' ' ' TRP . . . -55.13 -59.8 4.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -177.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.548 HG12 ' O ' ' B' ' 85' ' ' TRP . 32.1 pt -68.56 -27.94 38.33 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.707 0 C-N-CA 120.389 -0.524 . . . . 0.0 111.216 -178.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 90' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' B' ' 86' ' ' LYS . 53.8 tt0 -62.81 -61.76 2.19 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -65.31 -35.19 80.24 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.285 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.02 -33.24 65.62 Favored 'General case' 0 C--O 1.247 0.926 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 25.0 tptp . . . . . 0 CA--C 1.51 -0.562 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 12' ' ' PHE . 10.2 tp . . . . . 0 N--CA 1.43 -1.425 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 21.2 p -80.81 155.95 26.38 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.816 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -57.45 -44.23 84.61 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -173.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -69.18 -34.05 74.33 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.57 -177.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -63.55 -44.14 95.01 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.495 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 29.6 mt -61.61 -33.25 56.46 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.103 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.541 179.149 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.13 -46.17 85.3 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-O 121.019 0.437 . . . . 0.0 110.454 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.32 -48.94 75.69 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.406 -0.815 . . . . 0.0 108.986 175.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 56.6 m-85 -71.41 -16.6 62.4 Favored 'General case' 0 C--O 1.187 -2.187 0 CA-C-N 115.324 -0.853 . . . . 0.0 113.148 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 96.0 mttt -69.12 -43.83 73.63 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-O 121.539 0.685 . . . . 0.0 109.279 173.209 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -71.49 -41.13 69.69 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.644 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.43 -27.96 65.72 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.332 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.435 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 26.2 t80 -64.88 -52.74 54.89 Favored 'General case' 0 C--O 1.198 -1.623 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -71.84 -16.76 62.17 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 123.389 0.431 . . . . 0.0 110.836 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.4 tp -65.72 -36.55 83.93 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 174.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.412 ' CE2' HG21 ' A' ' 35' ' ' VAL . 6.5 m-85 -89.4 -41.86 11.86 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.619 175.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -80.65 81.94 6.78 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-O 122.582 1.182 . . . . 0.0 109.588 176.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -75.96 -19.61 58.6 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 114.287 -1.324 . . . . 0.0 112.861 -173.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.605 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 24.7 m-20 -78.15 -14.46 59.46 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.218 178.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.18 33.37 85.01 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.605 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 6.3 p-10 -112.97 -16.24 12.71 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.939 0.399 . . . . 0.0 110.793 -176.423 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.28 26.33 14.25 Favored Glycine 0 N--CA 1.441 -1.002 0 N-CA-C 115.635 1.014 . . . . 0.0 115.635 176.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.3 p -141.68 130.53 23.0 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 118.233 1.017 . . . . 0.0 109.096 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 61.2 mt -91.97 115.97 32.12 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.172 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.2 p -96.21 166.78 11.57 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 123.807 0.692 . . . . 0.0 109.944 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 36.4 p -64.27 -27.34 68.97 Favored 'General case' 0 C--O 1.249 1.075 0 CA-C-O 121.216 0.532 . . . . 0.0 110.087 177.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -54.59 -56.85 14.71 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 114.971 -1.013 . . . . 0.0 108.911 174.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.67 -40.13 92.08 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.167 -1.379 . . . . 0.0 111.122 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.421 ' HB3' HD22 ' A' ' 48' ' ' LEU . 91.5 mt -56.53 -60.26 3.8 Favored 'General case' 0 C--O 1.212 -0.898 0 O-C-N 123.58 0.55 . . . . 0.0 110.49 175.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.6 -30.39 72.0 Favored Glycine 0 C--O 1.216 -1.02 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.773 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.6 m -68.98 -49.72 55.38 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.716 0.258 . . . . 0.0 110.915 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.577 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 27.1 m -66.91 -39.18 82.93 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.1 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -58.52 -45.48 88.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.532 0.52 . . . . 0.0 110.261 175.226 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -62.83 -35.41 79.84 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 123.255 0.622 . . . . 0.0 109.951 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 m -76.34 -12.93 60.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.814 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 97.4 mt -96.9 -17.68 19.99 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.169 177.185 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.8 32.11 9.47 Favored Glycine 0 C--N 1.311 -0.818 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -129.49 133.34 47.23 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -129.94 81.64 68.49 Favored Pre-proline 0 C--N 1.305 -1.363 0 O-C-N 121.034 -1.041 . . . . 0.0 113.596 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -78.68 155.56 27.47 Favored 'Trans proline' 0 C--O 1.247 0.951 0 C-N-CA 122.13 1.887 . . . . 0.0 109.994 171.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.459 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 70.4 p -84.1 167.21 17.0 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.793 0.33 . . . . 0.0 111.757 -177.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -55.78 -45.73 78.09 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.506 1.122 . . . . 0.0 112.077 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.79 -41.98 92.38 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 120.766 0.317 . . . . 0.0 110.942 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -63.92 -48.33 77.02 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.476 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 44' ' ' THR . 91.1 mt -59.0 -42.65 90.59 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.231 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -69.78 -41.84 74.59 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -66.33 -35.92 81.6 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.436 0.636 . . . . 0.0 109.765 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.43 ' HB3' ' O ' ' A' ' 48' ' ' LEU . 38.7 ttm -57.35 -39.97 77.05 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.593 1.557 . . . . 0.0 110.159 177.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 59.3 mt -74.27 -49.6 31.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.499 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.17 -31.0 62.99 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.383 -0.826 . . . . 0.0 113.02 -172.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -70.64 -11.36 60.89 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.504 HG11 ' SD ' ' A' ' 71' ' ' MET . 28.4 m -119.89 -18.19 6.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 O-C-N 122.403 -0.186 . . . . 0.0 110.863 174.085 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -70.13 107.72 3.8 Favored 'General case' 0 N--CA 1.444 -0.772 0 O-C-N 123.777 0.673 . . . . 0.0 111.076 -176.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.86 -9.86 54.77 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.602 -176.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.58 -11.63 20.82 Favored 'General case' 0 CA--C 1.493 -1.244 0 C-N-CA 119.964 -0.694 . . . . 0.0 110.503 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.63 41.95 99.07 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 -174.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.9 p-10 -114.3 -11.23 12.6 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.187 0.518 . . . . 0.0 110.867 -176.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.29 15.6 55.22 Favored Glycine 0 N--CA 1.431 -1.635 0 C-N-CA 120.82 -0.705 . . . . 0.0 114.418 173.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 11.9 p -137.52 147.11 44.93 Favored 'General case' 0 C--O 1.248 1.022 0 CA-C-N 117.812 0.806 . . . . 0.0 111.628 177.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.567 HG21 ' HE2' ' A' ' 71' ' ' MET . 15.6 mt -99.68 110.53 27.05 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -84.58 -179.55 7.17 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.421 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 44.7 t80 -58.76 -53.93 61.36 Favored Pre-proline 0 C--N 1.311 -1.098 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -175.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.2 Cg_endo -52.98 -41.91 68.1 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.901 2.401 . . . . 0.0 111.757 176.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -67.25 -44.74 78.67 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.022 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.582 ' O ' ' HG2' ' A' ' 72' ' ' MET . 86.6 t80 -60.12 -41.82 93.45 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.049 0.539 . . . . 0.0 109.846 177.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.415 HD11 ' CE2' ' A' ' 65' ' ' PHE . 92.9 mt -65.09 -55.55 18.11 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.353 177.254 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 94.8 m -55.94 -41.43 74.63 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.417 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.567 ' HE2' HG21 ' A' ' 63' ' ' ILE . 20.0 ttp -55.65 -47.03 77.33 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.629 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.582 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 10.5 mmt -71.73 -41.31 68.66 Favored 'General case' 0 CA--C 1.486 -1.494 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.769 -176.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.5 -27.89 69.28 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.542 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -83.55 -30.59 26.94 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.453 0.644 . . . . 0.0 110.776 175.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -85.31 -3.29 58.78 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.895 0.855 . . . . 0.0 110.272 -173.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.522 ' HG3' ' O ' ' A' ' 72' ' ' MET . 61.7 mtt . . . . . 0 N--CA 1.429 -1.475 0 CA-C-O 121.947 0.88 . . . . 0.0 110.053 175.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 . . . . . 0 N--CA 1.442 -0.862 0 CA-C-O 121.069 0.462 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -63.84 -33.52 75.88 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.938 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 34.3 tt0 -65.3 -31.1 72.07 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 122.106 0.955 . . . . 0.0 109.494 178.219 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.7 mm -81.42 -29.09 10.57 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 -175.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -78.73 -26.25 44.68 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.617 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.456 ' HB3' ' O ' ' A' ' 84' ' ' GLU . 41.2 tt0 -62.67 -54.87 32.88 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 172.097 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.45 -39.74 76.95 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 113.741 -1.572 . . . . 0.0 110.617 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -62.49 -46.32 88.97 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.49 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 78.5 mtm180 -68.02 -25.09 65.21 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -178.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.416 HG11 ' HB1' ' B' ' 92' ' ' ALA . 14.0 p -82.79 -19.72 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 120.196 -0.601 . . . . 0.0 110.633 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -91.84 -56.84 2.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -84.98 83.99 7.87 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 122.09 0.948 . . . . 0.0 109.155 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -78.84 -35.17 44.37 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.642 -177.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -72.16 -14.32 61.79 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.516 0.674 . . . . 0.0 110.581 -178.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.62 54.09 10.95 Favored Glycine 0 N--CA 1.431 -1.685 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.288 175.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -89.21 -18.56 26.85 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 121.02 0.438 . . . . 0.0 110.13 176.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.18 13.0 75.17 Favored Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -178.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.434 ' HB3' ' HG2' ' A' ' 135' ' ' GLN . 76.4 m-85 -149.7 143.21 25.32 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.552 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.8 mt -87.84 109.68 19.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.8 m -80.18 140.04 36.51 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.42 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -59.47 -39.45 83.75 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 122.48 0.312 . . . . 0.0 111.416 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.81 -50.18 74.49 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.303 0.377 . . . . 0.0 111.497 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -70.51 -38.21 74.25 Favored 'General case' 0 CA--C 1.506 -0.749 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.787 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.484 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.5 tm? -59.58 -43.89 93.5 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.497 ' HA ' HG11 ' A' ' 121' ' ' VAL . 39.2 ttt180 -61.62 -45.13 95.4 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.536 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.5 m170 -59.87 -49.4 77.85 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.671 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.583 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -64.88 -33.36 63.03 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.385 0 C-N-CA 120.134 -0.626 . . . . 0.0 110.573 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.484 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.1 mmt -61.23 -41.94 97.75 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 120.887 0.375 . . . . 0.0 111.534 179.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 61.3 m -61.0 -38.51 86.29 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.217 176.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -76.73 -22.59 53.64 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.073 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 95.1 mt -88.95 -19.71 25.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.201 0.524 . . . . 0.0 110.541 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.36 0.55 55.71 Favored Glycine 0 N--CA 1.436 -1.336 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.162 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -70.62 -38.15 73.9 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.8 mttm 59.24 33.27 22.55 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.32 174.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.438 HD22 ' HG2' ' A' ' 120' ' ' GLU . 60.2 mt -64.52 138.25 58.3 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.621 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 36.8 p -76.91 174.42 10.6 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.857 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -63.35 -44.32 95.15 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 116.9 -0.136 . . . . 0.0 111.263 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.506 ' CD ' ' H ' ' A' ' 119' ' ' GLU . 1.4 mp0 -59.52 -37.6 78.76 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.1 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.438 ' HG2' HD22 ' A' ' 116' ' ' LEU . 8.1 tp10 -66.78 -55.77 13.45 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.464 -178.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.499 ' O ' HG12 ' A' ' 125' ' ' ILE . 11.4 m -64.21 -32.55 57.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.032 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -60.88 -45.74 93.39 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.688 0.795 . . . . 0.0 110.295 175.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -65.18 -43.32 92.06 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.184 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 54.1 mtt -56.54 -37.27 70.27 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.301 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.9 mm -76.22 -58.27 4.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.258 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -50.97 -44.83 60.76 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.935 1.294 . . . . 0.0 113.957 -173.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -83.54 -13.61 54.11 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 119.65 -0.82 . . . . 0.0 111.081 -174.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -96.76 -22.3 17.04 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.505 0.669 . . . . 0.0 109.582 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -72.7 92.53 1.56 Allowed 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.546 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.412 ' HB ' ' HG3' ' A' ' 140' ' ' GLU . 57.0 mt -82.41 -19.59 10.4 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.668 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.841 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -89.22 -12.06 41.88 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-O 121.408 0.623 . . . . 0.0 110.866 -173.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.09 36.7 60.36 Favored Glycine 0 N--CA 1.429 -1.771 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.2 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -95.3 -16.6 22.3 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.393 0.616 . . . . 0.0 109.438 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.29 13.19 82.22 Favored Glycine 0 CA--C 1.503 -0.705 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -175.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.434 ' HG2' ' HB3' ' A' ' 99' ' ' TYR . 9.4 tt0 -151.09 144.73 25.01 Favored 'General case' 0 N--CA 1.418 -2.061 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 -176.31 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.552 HG13 ' HB ' ' A' ' 100' ' ' ILE . 2.4 p -97.27 112.21 28.8 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.99 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -172.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.45 ' HB3' ' OE2' ' A' ' 140' ' ' GLU . 45.1 t30 -76.38 162.62 27.72 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.825 178.037 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -56.21 -48.3 76.69 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 123.431 0.693 . . . . 0.0 112.374 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.533 ' HA ' HG22 ' A' ' 142' ' ' VAL . 41.3 mt-10 -66.65 -41.13 88.74 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.262 0.553 . . . . 0.0 111.422 -178.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.45 ' OE2' ' HB3' ' A' ' 137' ' ' ASN . 2.8 mp0 -56.78 -45.71 81.98 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.767 174.063 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -64.73 -50.84 65.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.843 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.533 HG22 ' HA ' ' A' ' 139' ' ' GLU . 24.2 m -62.43 -37.97 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -176.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -51.68 -59.51 4.21 Favored 'General case' 0 C--O 1.233 0.237 0 O-C-N 123.986 0.804 . . . . 0.0 110.482 -177.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.72 -26.68 44.81 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -172.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 2.6 tmm? . . . . . 0 C--N 1.318 -0.802 0 C-N-CA 120.275 -0.57 . . . . 0.0 110.959 -174.101 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt . . . . . 0 C--O 1.211 -0.944 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -69.55 -31.59 69.88 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.432 0.634 . . . . 0.0 109.334 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.98 -54.92 35.04 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.14 173.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 26.9 m95 -57.68 -40.96 80.61 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.341 175.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -54.72 -58.26 8.26 Favored 'General case' 0 CA--C 1.501 -0.934 0 C-N-CA 123.45 0.7 . . . . 0.0 110.169 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -65.49 -30.85 71.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.243 -0.583 . . . . 0.0 112.465 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.08 -47.67 73.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.301 0.572 . . . . 0.0 110.061 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 85.4 mt -66.47 -36.66 77.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.73 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -59.01 -45.36 90.88 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.407 ' CG ' ' HB3' ' A' ' 112' ' ' LEU . 4.0 tppp? -64.55 -43.87 92.59 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.271 175.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 92' ' ' ALA . . . . . 0.416 ' HB1' HG11 ' A' ' 91' ' ' VAL . . . -61.18 -33.72 73.9 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.318 0.58 . . . . 0.0 110.983 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 22.6 mtpp . . . . . 0 C--N 1.316 -0.873 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.857 176.508 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.468 HD23 HD22 ' A' ' 69' ' ' LEU . 12.0 tp . . . . . 0 N--CA 1.425 -1.695 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.9 p -82.59 152.94 25.72 Favored 'General case' 0 N--CA 1.428 -1.564 0 O-C-N 123.364 0.415 . . . . 0.0 110.9 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -53.53 -45.19 69.68 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -171.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.55 -37.91 88.09 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-O 120.733 0.301 . . . . 0.0 110.992 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.426 ' HB3' ' HE1' ' A' ' 76' ' ' MET . 5.8 mm-40 -72.76 -33.09 66.11 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.507 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 36.3 mt -66.08 -34.45 70.34 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.095 176.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.5 -37.78 80.39 Favored 'General case' 0 C--O 1.252 1.21 0 CA-C-O 121.815 0.817 . . . . 0.0 109.88 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -62.75 -40.08 96.13 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.155 176.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -79.75 -16.36 55.74 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 30.5 mmtp -61.92 -47.2 85.98 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 171.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -59.78 -52.95 63.26 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 114.285 -1.325 . . . . 0.0 110.327 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.94 82.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.76 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -65.78 -45.91 80.71 Favored 'General case' 0 C--O 1.206 -1.232 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.601 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 32.1 t -69.25 -23.74 63.9 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 120.732 0.301 . . . . 0.0 111.047 -177.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.292 1.0 OUTLIER -62.1 -57.03 13.09 Favored 'General case' 0 CA--C 1.476 -1.866 0 CA-C-O 123.196 1.474 . . . . 0.0 107.091 174.268 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.493 ' CZ ' HD23 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -74.43 -33.89 63.07 Favored 'General case' 1 N--CA 1.368 -4.564 0 CA-C-N 111.666 -2.515 . . . . 0.0 109.605 -167.72 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -78.19 84.38 4.41 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-O 122.235 1.017 . . . . 0.0 108.416 173.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.7 mmtm -67.75 -32.23 72.68 Favored 'General case' 0 N--CA 1.421 -1.908 0 CA-C-N 113.931 -1.486 . . . . 0.0 112.439 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -87.34 -13.48 43.44 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.919 -176.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.96 50.57 64.33 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 -177.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -113.4 -12.11 13.03 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -176.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.88 5.8 57.34 Favored Glycine 0 C--N 1.306 -1.128 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.309 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.8 p -143.04 145.62 33.07 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 117.758 0.779 . . . . 0.0 111.838 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.8 mt -95.46 118.02 40.74 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 69.6 p -100.79 169.5 8.96 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.139 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 77.8 p -63.31 -30.95 71.99 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 121.255 0.55 . . . . 0.0 109.995 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.1 tttm -50.04 -55.97 12.66 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.759 1.223 . . . . 0.0 109.348 175.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -67.65 -40.07 84.57 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.626 -176.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.493 HD23 ' CZ ' ' A' ' 19' ' ' PHE . 83.9 mt -54.17 -55.85 23.88 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.978 0.894 . . . . 0.0 109.498 177.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.76 -21.38 73.01 Favored Glycine 0 C--O 1.215 -1.093 0 CA-C-N 115.4 -0.818 . . . . 0.0 113.288 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.7 m -74.32 -48.27 29.32 Favored 'General case' 0 C--O 1.254 1.293 0 CA-C-N 117.497 0.648 . . . . 0.0 110.376 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 m -68.64 -32.81 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.463 ' HB3' ' HB3' ' A' ' 41' ' ' GLN . 41.1 mtm -73.26 -27.71 61.73 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -61.24 -39.69 91.25 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.031 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.0 m -63.46 -27.55 69.36 Favored 'General case' 0 CA--C 1.554 1.129 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.457 176.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.412 HD12 ' HB2' ' A' ' 41' ' ' GLN . 2.4 tm? -88.88 -23.64 22.71 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.194 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 103.74 11.99 31.4 Favored Glycine 0 C--N 1.308 -1.026 0 C-N-CA 120.189 -1.005 . . . . 0.0 112.39 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.463 ' HB3' ' HB3' ' A' ' 36' ' ' MET . 2.4 tp-100 -101.28 125.01 47.86 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 179.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -125.87 75.26 71.2 Favored Pre-proline 0 C--N 1.294 -1.825 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.432 ' HG2' HD21 ' A' ' 48' ' ' LEU . 5.6 Cg_exo -77.64 147.91 25.39 Favored 'Trans proline' 0 N--CA 1.448 -1.164 0 C-N-CA 121.777 1.651 . . . . 0.0 109.977 176.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.5 p -68.56 154.02 42.66 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-O 120.533 0.206 . . . . 0.0 110.845 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -59.48 -30.57 68.63 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 122.801 0.44 . . . . 0.0 110.982 -177.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.27 78.54 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.338 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 51' ' ' MET . 55.2 mm-40 -65.97 -43.34 88.14 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.98 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.432 HD21 ' HG2' ' A' ' 43' ' ' PRO . 85.6 mt -67.43 -34.15 76.62 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.327 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.41 -44.77 90.19 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 178.181 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.56 -41.22 98.42 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.35 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 67.5 mtt -61.84 -42.53 99.14 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.084 178.099 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.9 mt -63.36 -45.07 99.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.998 0.428 . . . . 0.0 110.584 176.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -58.59 -18.28 28.8 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -175.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -64.82 -41.49 95.72 Favored 'General case' 0 N--CA 1.39 -3.472 0 O-C-N 121.783 -0.573 . . . . 0.0 110.051 177.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.582 HG11 ' SD ' ' A' ' 71' ' ' MET . 17.1 m -104.74 -17.33 7.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.429 -178.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -67.89 113.43 5.61 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -178.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.7 -23.73 36.61 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.229 0.537 . . . . 0.0 110.612 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -99.01 -11.89 21.1 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.399 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.52 51.55 57.12 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.642 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -115.22 -4.19 12.46 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 120.84 0.353 . . . . 0.0 111.906 -176.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.56 13.66 37.4 Favored Glycine 0 N--CA 1.438 -1.22 0 C-N-CA 120.829 -0.701 . . . . 0.0 113.299 174.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 11.2 p -141.48 139.55 33.35 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.882 0.341 . . . . 0.0 110.564 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 mt -91.47 113.25 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.941 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -83.85 166.19 18.13 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.463 ' CE2' HD11 ' A' ' 69' ' ' LEU . 56.5 t80 -56.79 -57.69 22.36 Favored Pre-proline 0 CA--C 1.555 1.145 0 O-C-N 123.568 0.543 . . . . 0.0 112.213 -177.173 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.17 -39.51 90.62 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.496 2.131 . . . . 0.0 112.539 177.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -63.4 -44.97 93.15 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.332 0.586 . . . . 0.0 110.287 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.63 -26.32 57.66 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.665 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.468 HD22 HD23 ' A' ' 4' ' ' LEU . 80.4 mt -63.98 -42.1 97.33 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 174.279 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.41 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 47.2 m -56.4 -48.69 76.4 Favored 'General case' 0 C--O 1.239 0.544 0 O-C-N 123.835 0.709 . . . . 0.0 109.152 175.508 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.582 ' SD ' HG11 ' A' ' 55' ' ' VAL . 40.4 ttp -54.65 -55.4 30.0 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.841 177.367 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 20.7 mmt -62.33 -38.62 90.16 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.4 -19.31 63.81 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 70' ' ' THR . 95.0 mtt180 -84.11 -29.86 26.42 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.23 0.538 . . . . 0.0 110.507 173.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -83.68 -33.74 25.12 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.803 0.811 . . . . 0.0 109.996 -176.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.426 ' HE1' ' HB3' ' A' ' 8' ' ' GLN . 34.9 ttm . . . . . 0 C--N 1.303 -1.454 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.842 -176.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 121.838 0.828 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.48 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -60.34 -45.43 93.48 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.312 -1.313 . . . . 0.0 112.331 -175.715 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -59.52 -42.69 92.84 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 121.776 0.798 . . . . 0.0 110.356 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.461 HG21 HG12 ' A' ' 142' ' ' VAL . 8.0 mm -70.6 -42.87 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 CA-C-N 114.113 -1.403 . . . . 0.0 108.929 -173.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -71.16 -38.08 72.2 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.682 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.507 ' HB2' ' HE2' ' B' ' 93' ' ' LYS . 52.5 mt-10 -58.62 -46.82 86.24 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 175.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.76 -40.1 91.71 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.094 -179.043 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -65.44 -49.33 69.54 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.16 0.505 . . . . 0.0 109.966 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 24.5 ttp85 -58.35 -38.79 77.9 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.375 1.07 . . . . 0.0 112.432 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 9.6 p -75.97 -19.57 15.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.643 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -86.69 -50.81 6.52 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.453 174.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -95.59 76.46 3.28 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.947 0.879 . . . . 0.0 110.994 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -79.06 -29.4 43.44 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.542 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.99 -12.98 61.49 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.241 0.543 . . . . 0.0 111.457 -178.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.56 48.47 10.5 Favored Glycine 0 N--CA 1.435 -1.407 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.743 176.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -80.92 -19.91 43.24 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.23 -0.38 85.66 Favored Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 110.759 -0.937 . . . . 0.0 110.759 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.1 p90 -156.74 158.24 36.54 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -178.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.576 ' HB ' HG13 ' A' ' 136' ' ' VAL . 1.7 mt -87.41 106.09 15.84 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.3 t -93.82 143.71 26.09 Favored 'General case' 0 N--CA 1.422 -1.825 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.499 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.56 -38.99 92.93 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 123.218 0.607 . . . . 0.0 111.45 -177.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.7 -46.21 89.76 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.394 0.616 . . . . 0.0 109.981 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.581 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 2.8 tp10 -66.71 -45.64 78.08 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.392 176.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.99 -35.99 78.28 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -175.043 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.498 ' HB2' HG21 ' A' ' 121' ' ' VAL . 29.5 ttp180 -64.96 -36.2 83.63 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.296 177.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' HIS . . . . . 0.581 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 42.9 m170 -56.72 -50.97 70.6 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.124 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.697 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.1 p -70.72 -33.06 51.31 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.838 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.36 -177.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 20.9 mmt -62.3 -46.72 87.48 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.3 m -65.23 -30.88 71.81 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.374 0.607 . . . . 0.0 109.498 177.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -71.89 -32.32 67.31 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.462 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 71.9 mt -85.47 -19.38 31.33 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 121.024 0.44 . . . . 0.0 110.69 -176.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.54 14.15 57.35 Favored Glycine 0 N--CA 1.434 -1.435 0 C-N-CA 120.56 -0.828 . . . . 0.0 111.606 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.428 ' OE1' ' HG3' ' B' ' 91' ' ' LYS . 30.9 mm-40 -74.48 -36.85 63.3 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 55.94 62.23 2.47 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 122.421 1.105 . . . . 0.0 110.78 178.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 71.2 mt -92.81 147.13 23.11 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.2 p -77.84 174.43 11.03 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 120.354 -0.538 . . . . 0.0 110.462 -179.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -68.37 -38.05 81.01 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.149 0.499 . . . . 0.0 109.705 -178.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 119' ' ' GLU . 1.4 mp0 -63.45 -42.49 98.64 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 177.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -61.99 -54.85 35.96 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.437 1.095 . . . . 0.0 110.53 -177.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.498 HG21 ' HB2' ' A' ' 106' ' ' ARG . 25.3 m -63.39 -36.98 78.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.002 -177.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -72.18 -32.35 66.75 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.699 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -64.2 -47.58 79.21 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 mtt -51.68 -50.47 60.36 Favored 'General case' 0 CA--C 1.503 -0.844 0 O-C-N 123.601 0.563 . . . . 0.0 110.381 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.532 ' CG2' ' HA ' ' A' ' 135' ' ' GLN . 40.4 mm -60.11 -49.46 83.99 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.538 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.143 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.4 ttm180 -65.64 -30.82 71.58 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 123.298 0.639 . . . . 0.0 111.474 -175.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -78.03 -34.03 50.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.842 0.353 . . . . 0.0 110.683 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.13 -28.12 42.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.648 0.737 . . . . 0.0 109.282 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -74.84 94.4 2.77 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.681 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.433 ' HB ' ' HG3' ' A' ' 140' ' ' GLU . 9.6 mt -82.19 -19.06 10.81 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.804 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.151 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -82.62 -11.5 58.34 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.591 -173.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.3 24.06 72.06 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.177 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -87.11 -17.08 33.65 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.44 0.638 . . . . 0.0 109.768 -177.427 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 97.01 -18.62 57.2 Favored Glycine 0 N--CA 1.437 -1.277 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.192 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.532 ' HA ' ' CG2' ' A' ' 125' ' ' ILE . 31.8 mt-30 -134.44 147.33 50.41 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.576 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.7 p -94.76 124.03 47.1 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -173.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -93.4 175.4 6.77 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.547 ' O ' HG13 ' A' ' 142' ' ' VAL . 73.5 t80 -60.19 -45.69 92.26 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -175.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.638 ' O ' HG22 ' A' ' 142' ' ' VAL . 35.6 mm-40 -61.59 -43.58 98.6 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.331 0.586 . . . . 0.0 111.644 -179.424 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.433 ' HG3' ' HB ' ' A' ' 130' ' ' ILE . 0.3 OUTLIER -68.14 -33.79 75.14 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.041 178.546 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -67.72 -38.97 84.3 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.998 176.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.638 HG22 ' O ' ' A' ' 139' ' ' GLU . 7.2 m -59.05 -38.53 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.46 -178.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -76.37 -41.46 48.01 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.617 -175.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 3.7 ppp? -76.52 -32.2 58.13 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.155 -0.618 . . . . 0.0 112.101 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.5 tpt . . . . . 0 C--N 1.322 -0.59 0 CA-C-O 121.114 0.483 . . . . 0.0 110.571 179.606 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp . . . . . 0 N--CA 1.418 -2.04 0 CA-C-O 120.404 0.145 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -58.92 -55.49 34.42 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.481 1.134 . . . . 0.0 108.675 176.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.03 -50.99 60.33 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 112.613 -2.085 . . . . 0.0 112.263 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -72.6 -28.6 62.88 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -58.84 -55.93 28.77 Favored 'General case' 0 CA--C 1.481 -1.693 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 172.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -46.66 -58.33 3.94 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 125.113 1.508 . . . . 0.0 111.333 175.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.12 -52.85 62.85 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 45.4 mm -65.14 -49.01 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-O 120.99 0.424 . . . . 0.0 110.102 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -60.92 -37.35 81.98 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.968 0.907 . . . . 0.0 112.047 -176.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.428 ' HG3' ' OE1' ' A' ' 114' ' ' GLU . 14.0 mmmm -81.73 -42.18 20.2 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.95 -51.26 10.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.074 0.464 . . . . 0.0 111.588 -177.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.507 ' HE2' ' HB2' ' A' ' 87' ' ' GLU . 58.2 tttm . . . . . 0 C--N 1.32 -0.701 0 CA-C-O 122.356 1.074 . . . . 0.0 110.321 -175.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.428 ' HB3' HD11 ' A' ' 9' ' ' ILE . 11.1 tp . . . . . 0 N--CA 1.437 -1.104 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.5 p -82.65 153.76 25.24 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.255 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -53.62 -44.05 69.18 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 125.018 1.327 . . . . 0.0 110.959 -176.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -55.89 -49.01 74.6 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.107 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -68.57 -47.22 67.36 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.722 -178.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.622 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 60.3 mt -57.37 -40.24 73.02 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.464 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.329 -178.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.31 -49.03 79.38 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-O 120.792 0.33 . . . . 0.0 111.4 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -60.2 -41.18 92.43 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.637 0.732 . . . . 0.0 109.578 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.494 ' CE2' ' HG2' ' A' ' 72' ' ' MET . 36.5 m-85 -77.27 -13.62 59.9 Favored 'General case' 0 C--O 1.207 -1.156 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.622 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 97.7 mttt -69.64 -43.41 72.67 Favored 'General case' 0 C--O 1.249 1.059 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 173.229 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -64.64 -45.45 86.76 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.014 -0.993 . . . . 0.0 110.18 176.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.454 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -58.52 -47.88 82.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.356 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -57.03 -49.15 76.7 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.336 0.655 . . . . 0.0 111.196 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.3 m -76.99 -19.61 57.08 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.234 -174.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 15' ' ' ALA . 4.5 pp -79.21 -21.98 45.52 Favored 'General case' 0 CA--C 1.502 -0.9 0 C-N-CA 118.979 -1.088 . . . . 0.0 110.741 176.01 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.462 ' CE2' ' HA ' ' A' ' 32' ' ' LEU . 2.7 t80 -80.7 -50.85 9.37 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.46 79.72 3.17 Favored 'General case' 0 N--CA 1.416 -2.145 0 CA-C-N 113.012 -1.904 . . . . 0.0 110.47 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -54.58 -34.39 61.85 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 113.584 -1.644 . . . . 0.0 112.793 -175.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -92.87 -8.18 44.12 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.734 -170.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.5 37.12 94.02 Favored Glycine 0 C--O 1.235 0.208 0 C-N-CA 121.344 -0.455 . . . . 0.0 112.626 177.023 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -100.87 -16.2 17.32 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 122.755 -0.262 . . . . 0.0 111.288 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.5 6.96 76.59 Favored Glycine 0 N--CA 1.439 -1.126 0 C-N-CA 120.554 -0.831 . . . . 0.0 114.4 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.8 p -128.68 130.69 47.53 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 118.063 0.931 . . . . 0.0 109.737 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 51.2 mt -96.15 122.01 47.24 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.492 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.4 p -101.86 168.32 9.5 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.037 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.426 HG23 HD12 ' A' ' 52' ' ' ILE . 32.4 p -64.84 -27.74 69.08 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.131 0.491 . . . . 0.0 110.496 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -57.47 -57.16 13.87 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 177.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.49 -37.9 89.16 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 114.543 -1.208 . . . . 0.0 111.834 -176.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 28' ' ' THR . 96.4 mt -52.85 -62.84 1.39 Allowed 'General case' 0 CA--C 1.501 -0.932 0 O-C-N 124.237 0.961 . . . . 0.0 109.85 178.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.07 -28.52 71.56 Favored Glycine 0 N--CA 1.428 -1.861 0 C-N-CA 119.875 -1.155 . . . . 0.0 113.268 -176.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.3 m -60.82 -55.36 34.01 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 118.105 0.953 . . . . 0.0 111.007 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.69 -35.05 30.12 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.746 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.3 mtp -64.98 -37.29 87.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.419 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -64.85 -40.77 95.68 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 122.703 0.401 . . . . 0.0 110.027 176.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.4 m -65.4 -26.82 68.16 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.371 0.605 . . . . 0.0 110.339 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.423 ' HB3' ' HE3' ' B' ' 91' ' ' LYS . 4.6 mm? -94.72 8.98 40.68 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.785 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.447 ' HA3' ' HA3' ' A' ' 113' ' ' GLY . . . 87.03 35.54 9.72 Favored Glycine 0 C--N 1.312 -0.786 0 C-N-CA 120.032 -1.08 . . . . 0.0 115.719 172.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -143.16 121.78 12.53 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 172.309 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -116.06 84.49 13.71 Favored Pre-proline 0 C--N 1.309 -1.183 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.723 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.657 ' HG2' HD21 ' A' ' 48' ' ' LEU . 19.1 Cg_endo -84.47 169.22 11.07 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.386 2.058 . . . . 0.0 111.655 176.208 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.0 p -96.48 170.3 9.31 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.848 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -56.49 -42.48 78.36 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.55 1.14 . . . . 0.0 110.368 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.24 -47.77 84.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.364 -178.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -63.73 -43.69 95.74 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.361 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.657 HD21 ' HG2' ' A' ' 43' ' ' PRO . 94.1 mt -62.7 -34.09 76.42 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.709 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -72.58 -34.39 67.42 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.69 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -65.68 -42.26 91.46 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.2 mtt -55.28 -42.84 74.1 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.655 177.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.426 HD12 HG23 ' A' ' 29' ' ' THR . 33.3 mt -71.16 -56.52 10.27 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.612 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.815 176.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -54.22 -31.04 52.15 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -174.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.94 -42.5 89.96 Favored 'General case' 0 N--CA 1.415 -2.19 0 C-N-CA 124.009 0.924 . . . . 0.0 110.744 175.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.55 HG11 ' SD ' ' A' ' 71' ' ' MET . 9.5 m -102.84 -18.9 6.37 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.194 -175.225 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -68.63 109.7 3.9 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.56 -40.33 21.06 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.041 -173.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -94.44 -9.91 34.07 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.143 -176.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.88 53.24 31.83 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.977 177.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.2 p-10 -107.6 -9.71 15.82 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 120.65 -0.42 . . . . 0.0 111.241 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 106.95 -0.05 35.94 Favored Glycine 0 N--CA 1.439 -1.159 0 C-N-CA 120.386 -0.911 . . . . 0.0 113.306 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.5 p -135.27 151.33 50.47 Favored 'General case' 0 C--O 1.249 1.068 0 CA-C-N 117.609 0.705 . . . . 0.0 111.888 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.1 mt -93.71 110.34 23.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 175.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -82.49 175.11 10.47 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 177.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.448 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 59.8 t80 -61.08 -52.9 68.56 Favored Pre-proline 0 C--N 1.302 -1.487 0 CA-C-O 119.255 -0.403 . . . . 0.0 111.484 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -53.02 -34.94 69.89 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.769 2.313 . . . . 0.0 112.522 174.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -74.39 -39.87 62.4 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -61.85 -42.54 99.17 Favored 'General case' 0 C--O 1.246 0.889 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 76.3 mt -60.47 -46.55 89.66 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.022 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.2 m -57.89 -42.22 84.18 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 123.52 0.512 . . . . 0.0 110.853 177.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.55 ' SD ' HG11 ' A' ' 55' ' ' VAL . 30.6 ttp -57.79 -45.92 85.35 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 121.021 0.439 . . . . 0.0 111.451 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.494 ' HG2' ' CE2' ' A' ' 12' ' ' PHE . 34.6 tpp -76.3 -33.74 59.06 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.222 -176.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.35 -21.73 62.0 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.745 -179.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -83.64 -27.49 29.09 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 121.549 0.69 . . . . 0.0 109.663 173.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -86.39 -38.66 17.17 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.302 -173.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.411 ' HG2' ' OE1' ' A' ' 84' ' ' GLU . 32.5 mtm . . . . . 0 CA--C 1.507 -0.684 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.99 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -60.46 -62.73 1.65 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.411 ' OE1' ' HG2' ' A' ' 76' ' ' MET . 45.3 mt-10 -67.04 -35.09 79.12 Favored 'General case' 0 CA--C 1.485 -1.539 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.315 -178.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.407 ' CG2' HG12 ' A' ' 142' ' ' VAL . 26.8 mm -61.13 -46.02 97.44 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.408 -176.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.1 ttp-105 -67.97 -50.16 57.37 Favored 'General case' 0 C--O 1.196 -1.745 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.032 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -55.49 -39.2 70.12 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.5 86.81 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 120.501 0.191 . . . . 0.0 111.132 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -71.57 -49.15 43.28 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -56.59 -32.5 65.29 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 126.521 1.929 . . . . 0.0 112.485 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.52 -28.63 16.11 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 C-N-CA 120.197 -0.601 . . . . 0.0 111.304 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -81.6 -47.64 12.78 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 174.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -83.84 61.74 6.55 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 122.974 1.369 . . . . 0.0 107.452 175.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -77.84 -24.03 48.76 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.415 -172.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -93.49 -13.34 27.97 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.497 0.665 . . . . 0.0 110.359 -177.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.2 62.85 1.46 Allowed Glycine 0 N--CA 1.435 -1.372 0 C-N-CA 120.494 -0.86 . . . . 0.0 111.589 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -106.02 -19.26 13.78 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-O 121.587 0.708 . . . . 0.0 109.246 177.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.08 -13.38 59.73 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.672 175.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.412 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 83.4 m-85 -139.7 132.32 28.84 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -176.465 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.57 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.7 mt -80.37 121.82 34.48 Favored 'Isoleucine or valine' 0 C--O 1.252 1.225 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.4 m -101.19 161.73 13.4 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 123.349 0.406 . . . . 0.0 109.978 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.12 -52.89 20.1 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -172.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.33 -29.98 69.68 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 121.73 0.776 . . . . 0.0 109.226 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.18 -39.85 93.44 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.307 -1.315 . . . . 0.0 110.499 175.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.512 HD22 HG12 ' A' ' 121' ' ' VAL . 4.9 tt -64.85 -45.79 84.61 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 177.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.511 ' HG3' HG11 ' A' ' 121' ' ' VAL . 51.0 mtp180 -61.35 -35.67 78.06 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.919 -0.488 . . . . 0.0 111.67 175.6 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -61.37 -51.56 68.29 Favored 'General case' 0 C--O 1.259 1.587 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.818 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.63 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 10.5 p -65.59 -35.41 75.17 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.635 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.911 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.458 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.0 mmt -60.75 -40.18 91.5 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 56.8 m -59.87 -40.9 90.22 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 176.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -72.96 -26.82 61.51 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.491 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 81.8 mt -86.56 -7.45 58.36 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.166 0.507 . . . . 0.0 109.901 -178.305 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLY . . . . . 0.447 ' HA3' ' HA3' ' A' ' 40' ' ' GLY . . . 70.37 13.6 70.91 Favored Glycine 0 N--CA 1.432 -1.586 0 CA-C-N 115.085 -0.961 . . . . 0.0 113.168 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -86.84 -35.4 19.08 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp 57.15 94.78 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.307 1.043 . . . . 0.0 111.954 176.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 72.0 mt -110.91 155.86 22.03 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 120.894 0.378 . . . . 0.0 111.292 -176.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.0 p -85.37 161.12 19.6 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.607 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -64.26 -41.14 97.08 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -69.06 -33.36 73.45 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.646 0.736 . . . . 0.0 110.307 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -68.15 -51.59 44.19 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.583 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.512 HG12 HD22 ' A' ' 105' ' ' LEU . 16.7 m -67.79 -30.57 48.9 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.429 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.325 178.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.93 -44.01 90.89 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.299 178.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.97 -43.67 98.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 65.4 mtt -56.65 -55.0 39.58 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 124.01 0.819 . . . . 0.0 111.038 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.2 mm -58.11 -55.37 22.52 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.416 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.724 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 -58.14 -43.15 87.17 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 113.186 0.809 . . . . 0.0 113.186 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -76.09 -28.43 57.56 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.396 -176.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -80.12 -28.78 38.92 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.691 0.758 . . . . 0.0 110.076 177.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -76.42 85.45 3.16 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 122.118 0.961 . . . . 0.0 110.664 178.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.0 mt -78.01 -23.29 13.79 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.903 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -83.19 -10.97 58.3 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.907 0.384 . . . . 0.0 111.134 -175.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.34 37.55 70.6 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -94.97 -16.89 22.43 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 121.647 0.737 . . . . 0.0 109.417 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 97.47 -14.75 63.02 Favored Glycine 0 N--CA 1.444 -0.825 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -177.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.412 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 27.2 mp0 -133.98 138.36 45.38 Favored 'General case' 0 CA--C 1.49 -1.361 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 178.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.57 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.7 OUTLIER -80.75 121.46 34.26 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 CA-C-O 121.183 0.516 . . . . 0.0 111.815 -177.904 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.574 ' HB3' ' OE2' ' A' ' 140' ' ' GLU . 50.8 t30 -87.99 166.67 14.32 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.925 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.555 ' O ' HG13 ' A' ' 142' ' ' VAL . 91.1 t80 -61.07 -45.44 94.71 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 123.223 0.609 . . . . 0.0 112.318 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.48 ' O ' HG22 ' A' ' 142' ' ' VAL . 15.1 mm-40 -65.41 -40.86 93.89 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.282 0.563 . . . . 0.0 111.732 -178.444 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.574 ' OE2' ' HB3' ' A' ' 137' ' ' ASN . 4.8 mp0 -60.54 -43.62 97.0 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.272 175.274 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -60.09 -47.04 87.55 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.881 176.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.555 HG13 ' O ' ' A' ' 138' ' ' TYR . 4.4 m -63.6 -39.2 84.47 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.491 -178.002 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -65.49 -42.5 92.1 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.042 -176.494 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.473 ' HG3' ' N ' ' A' ' 145' ' ' MET . 3.4 ptm -78.62 -37.55 41.94 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 119.937 -0.705 . . . . 0.0 111.726 -178.294 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.473 ' N ' ' HG3' ' A' ' 144' ' ' MET . 3.0 tmm? . . . . . 0 C--N 1.316 -0.874 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.999 -171.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 mttt . . . . . 0 CA--C 1.513 -0.473 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -73.54 -43.06 60.84 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 176.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.68 -34.86 65.07 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.857 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -73.43 -36.11 65.89 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -58.57 -53.88 53.39 Favored 'General case' 0 CA--C 1.493 -1.214 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 174.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -57.52 -40.19 78.18 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 114.553 -1.203 . . . . 0.0 112.756 176.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.85 -54.72 38.29 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 122.46 0.304 . . . . 0.0 111.382 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.573 ' O ' ' HB3' ' B' ' 93' ' ' LYS . 44.3 pt -64.33 -35.82 75.29 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 CA-C-O 120.941 0.4 . . . . 0.0 110.611 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -69.59 -41.16 76.15 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.421 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.423 ' HE3' ' HB3' ' A' ' 39' ' ' LEU . 23.4 tptm -65.34 -45.49 84.02 Favored 'General case' 0 C--O 1.205 -1.248 0 C-N-CA 122.701 0.401 . . . . 0.0 110.508 -177.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.6 -47.55 11.97 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -175.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.573 ' HB3' ' O ' ' B' ' 89' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.473 0.725 0 CA-C-O 121.529 0.68 . . . . 0.0 112.083 -177.435 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 tp . . . . . 0 N--CA 1.441 -0.905 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 45.5 p -80.73 156.2 26.36 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.869 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -57.22 -33.33 67.43 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 123.45 0.7 . . . . 0.0 112.345 -174.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.512 ' CD ' ' H ' ' A' ' 7' ' ' GLU . 2.0 mp0 -61.01 -46.2 91.73 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.022 0.915 . . . . 0.0 109.293 178.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.463 ' O ' ' HB3' ' A' ' 11' ' ' GLU . 62.0 tt0 -75.08 -33.17 61.62 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 114.623 -1.172 . . . . 0.0 110.14 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.628 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 67.3 mt -63.98 -37.32 79.5 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.57 -40.89 88.83 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 122.631 0.372 . . . . 0.0 110.725 175.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.463 ' HB3' ' O ' ' A' ' 8' ' ' GLN . 10.3 tp10 -57.13 -50.75 71.84 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 174.6 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -62.68 -30.27 71.27 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.936 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.628 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 91.1 mttt -62.14 -48.26 80.89 Favored 'General case' 0 C--O 1.252 1.224 0 CA-C-O 121.243 0.544 . . . . 0.0 110.477 179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -71.98 -43.73 64.66 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.103 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.56 -48.58 74.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.927 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.54 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 56.7 t80 -58.15 -55.34 36.28 Favored 'General case' 0 C--O 1.189 -2.098 0 C-N-CA 124.082 0.953 . . . . 0.0 110.425 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.9 m -68.72 -17.02 63.99 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 123.402 0.438 . . . . 0.0 111.677 -174.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.87 -43.25 84.05 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 174.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.639 ' HB2' HG11 ' A' ' 35' ' ' VAL . 35.2 p90 -96.6 -24.06 16.21 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 119.713 -0.795 . . . . 0.0 111.945 -178.008 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -79.18 81.55 5.43 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 168.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -58.45 -31.43 67.77 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.466 -1.697 . . . . 0.0 114.241 -169.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.435 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 34.3 m-20 -88.05 -13.0 42.66 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.311 -0.956 . . . . 0.0 111.845 178.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.94 61.09 6.77 Favored Glycine 0 CA--C 1.518 0.233 0 O-C-N 123.285 0.365 . . . . 0.0 112.318 -179.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.435 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 5.3 m-20 -111.09 -16.8 13.39 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.108 0.48 . . . . 0.0 109.889 -175.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.8 13.87 64.02 Favored Glycine 0 C--O 1.215 -1.087 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -174.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.598 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 17.2 p -143.41 138.42 29.34 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 122.989 0.516 . . . . 0.0 109.973 177.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mt -104.81 127.7 59.08 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 177.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.7 p -98.86 171.55 8.0 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.1 p -58.93 -39.41 81.49 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 120.984 0.421 . . . . 0.0 110.502 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -50.66 -55.1 17.98 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.014 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -66.82 -44.29 81.53 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.755 -174.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 75.6 mt -53.6 -51.68 62.26 Favored 'General case' 0 CA--C 1.51 -0.579 0 O-C-N 123.851 0.719 . . . . 0.0 111.105 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.534 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -72.9 -37.02 57.09 Favored Glycine 0 C--O 1.192 -2.471 0 C-N-CA 119.25 -1.452 . . . . 0.0 112.832 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.2 m -58.73 -48.36 81.44 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-N 118.593 1.196 . . . . 0.0 110.716 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.639 HG11 ' HB2' ' A' ' 19' ' ' PHE . 17.0 m -67.59 -34.71 69.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.31 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.3 mtm -73.37 -37.0 66.18 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 31.2 mtm180 -66.43 -30.31 70.64 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.7 m -71.74 -30.68 65.88 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.496 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.7 mt -84.07 -15.18 48.36 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.816 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.5 37.1 1.97 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.697 -0.764 . . . . 0.0 114.633 175.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -148.42 131.17 16.0 Favored 'General case' 0 CA--C 1.503 -0.858 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 173.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -114.98 80.36 6.74 Favored Pre-proline 0 C--N 1.31 -1.133 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.639 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -76.12 154.44 37.33 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.154 1.903 . . . . 0.0 110.688 175.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.6 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 51.8 p -83.31 164.05 20.29 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -178.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -66.56 -27.1 67.47 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 -177.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.24 -45.13 91.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.313 0.577 . . . . 0.0 109.685 175.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' A' ' 51' ' ' MET . 34.5 mt-10 -67.49 -48.3 67.51 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.621 178.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 44' ' ' THR . 73.9 mt -57.27 -41.32 79.46 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.162 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 -70.42 -35.59 73.51 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.02 -178.276 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.47 -41.01 85.3 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.451 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 66.4 mtt -54.89 -46.07 74.77 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.194 176.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 67.6 mt -67.19 -55.11 18.82 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.778 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.311 178.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.448 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.6 t30 -55.72 -32.64 63.52 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -171.187 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -61.73 -36.75 81.88 Favored 'General case' 0 N--CA 1.385 -3.707 0 C-N-CA 123.408 0.683 . . . . 0.0 112.587 178.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.538 HG11 ' HB2' ' A' ' 71' ' ' MET . 34.5 m -98.43 -13.95 7.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-O 120.909 0.385 . . . . 0.0 110.149 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.448 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 33.2 t0 -79.21 105.61 10.66 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.89 -177.151 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.49 -9.31 56.48 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.964 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.17 -11.8 31.88 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.197 -176.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.99 37.59 91.68 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.799 -176.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -115.17 -14.96 11.71 Favored 'General case' 0 C--N 1.32 -0.712 0 O-C-N 122.673 -0.31 . . . . 0.0 111.248 -176.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.23 23.16 32.78 Favored Glycine 0 N--CA 1.433 -1.517 0 C-N-CA 120.438 -0.886 . . . . 0.0 113.385 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.7 p -133.57 136.74 45.12 Favored 'General case' 0 C--O 1.252 1.203 0 CA-C-N 117.37 0.585 . . . . 0.0 111.379 178.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.598 ' O ' ' HA ' ' A' ' 26' ' ' THR . 51.2 mt -91.69 110.74 23.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.121 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -75.35 154.9 37.01 Favored 'General case' 0 C--N 1.279 -2.461 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.462 ' CZ ' ' HG2' ' A' ' 13' ' ' LYS . 63.1 t80 -51.41 -51.62 67.27 Favored Pre-proline 0 C--N 1.311 -1.093 0 O-C-N 123.422 0.451 . . . . 0.0 111.668 176.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -49.98 -40.74 49.52 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.707 2.272 . . . . 0.0 112.397 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -69.6 -40.64 76.54 Favored 'General case' 0 C--O 1.22 -0.449 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.54 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 38.4 t80 -58.55 -40.49 83.17 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.205 0.602 . . . . 0.0 109.563 174.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 94.1 mt -64.94 -51.6 60.93 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.747 176.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 74.3 m -57.04 -45.87 82.84 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.826 0.45 . . . . 0.0 111.018 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.538 ' HB2' HG11 ' A' ' 55' ' ' VAL . 26.9 ttp -58.68 -44.09 90.15 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.49 0.716 . . . . 0.0 111.642 178.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.441 ' HE3' ' CE1' ' A' ' 68' ' ' PHE . 2.5 tpp -74.61 -36.3 62.95 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.153 -177.443 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.22 -48.57 80.86 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.269 177.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -70.12 -16.44 63.11 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.409 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.41 ' HD3' ' OE1' ' B' ' 90' ' ' GLN . 39.3 ttmt -88.82 -16.25 32.52 Favored 'General case' 0 C--N 1.297 -1.716 0 C-N-CA 123.032 0.533 . . . . 0.0 111.632 178.489 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.9 ttp . . . . . 0 C--O 1.244 0.812 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 -167.266 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 . . . . . 0 N--CA 1.418 -2.031 0 CA-C-O 120.662 0.267 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -68.85 -38.46 79.81 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.76 -173.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -56.76 -38.21 72.14 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.214 0.53 . . . . 0.0 110.058 175.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.489 HG21 HG12 ' A' ' 142' ' ' VAL . 15.0 mm -68.2 -46.83 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.693 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.5 ttm180 -71.02 -29.73 65.74 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 114.314 -1.312 . . . . 0.0 112.588 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -68.06 -44.47 76.27 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.504 0.669 . . . . 0.0 109.625 174.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.471 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -68.52 -24.29 64.63 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.741 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -81.46 -42.01 20.95 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 121.121 0.486 . . . . 0.0 109.903 176.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -57.39 -33.23 67.62 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.072 1.349 . . . . 0.0 112.612 -177.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.487 HG22 HG21 ' A' ' 108' ' ' VAL . 11.6 p -58.42 -31.08 42.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.255 178.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.507 ' HB3' HG23 ' A' ' 100' ' ' ILE . 61.2 m-85 -93.86 -60.93 1.64 Allowed 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -85.79 87.19 7.37 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 122.313 1.054 . . . . 0.0 110.149 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -78.51 -39.89 36.77 Favored 'General case' 0 C--N 1.288 -2.077 0 CA-C-N 113.399 -1.728 . . . . 0.0 111.259 -175.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -79.79 -13.15 59.63 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.919 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.87 50.88 5.35 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.309 -0.948 . . . . 0.0 110.921 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -97.9 -12.63 21.86 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-O 121.268 0.556 . . . . 0.0 109.835 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.403 ' O ' ' HA ' ' A' ' 137' ' ' ASN . . . 78.79 20.42 70.95 Favored Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.935 176.228 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.417 ' HA ' ' O ' ' A' ' 136' ' ' VAL . 21.8 p90 -150.52 154.89 38.43 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 117.037 0.418 . . . . 0.0 110.669 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.552 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.2 mt -110.65 137.62 42.27 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 177.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 14.8 m -116.69 154.72 30.09 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 123.973 0.796 . . . . 0.0 109.507 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.71 -44.15 82.43 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -175.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.68 -49.16 76.23 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.643 0.258 . . . . 0.0 110.945 -178.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -55.42 -46.62 76.65 Favored 'General case' 0 CA--C 1.501 -0.928 0 C-N-CA 123.164 0.586 . . . . 0.0 110.33 176.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.417 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.4 tt -59.16 -44.65 92.14 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-N 115.087 -0.96 . . . . 0.0 108.899 -173.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.666 ' HG3' HG21 ' A' ' 121' ' ' VAL . 33.0 mtp180 -62.29 -37.19 84.58 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 120.977 0.418 . . . . 0.0 111.805 174.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -60.96 -44.94 96.59 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.663 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.487 HG21 HG22 ' A' ' 91' ' ' VAL . 8.9 p -72.84 -31.39 36.09 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.213 0 C-N-CA 119.71 -0.796 . . . . 0.0 110.375 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.511 ' HG3' HD12 ' A' ' 116' ' ' LEU . 21.8 mmt -64.22 -44.73 90.98 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-O 120.57 0.224 . . . . 0.0 111.433 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 22.2 m -61.41 -33.55 73.88 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.245 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -75.21 -31.58 60.94 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.918 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.9 mt -81.88 -18.36 44.06 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.647 0.737 . . . . 0.0 109.904 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 86.09 21.93 50.62 Favored Glycine 0 N--CA 1.433 -1.552 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.54 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -101.6 122.28 43.56 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -83.16 107.88 16.03 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 123.475 0.484 . . . . 0.0 110.135 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.511 HD12 ' HG3' ' A' ' 109' ' ' MET . 20.8 mt -124.97 152.13 44.57 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 176.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 50.9 p -87.06 174.5 8.62 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -71.65 -30.09 65.35 Favored 'General case' 0 C--O 1.207 -1.134 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 175.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.9 -49.45 77.41 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.559 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -56.86 -55.22 37.22 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.166 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.666 HG21 ' HG3' ' A' ' 106' ' ' ARG . 11.3 m -68.5 -32.0 53.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.372 -175.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -67.42 -44.9 77.65 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -63.87 -39.7 94.81 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 123.472 0.483 . . . . 0.0 110.337 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.3 mtt -52.6 -54.16 36.81 Favored 'General case' 0 CA--C 1.499 -0.989 0 O-C-N 124.133 0.896 . . . . 0.0 110.452 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mm -65.39 -55.73 18.75 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.192 0 O-C-N 123.777 0.673 . . . . 0.0 110.448 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 50.7 ttt180 -49.06 -47.07 45.25 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 125.145 1.378 . . . . 0.0 113.989 -173.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -82.8 -27.2 31.11 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.665 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.86 -19.96 47.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 122.309 1.052 . . . . 0.0 109.454 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 134' ' ' GLY . 9.5 t70 -73.23 74.51 1.3 Allowed 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.643 176.05 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.1 mt -75.89 -14.65 15.22 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 CA-C-N 114.342 -1.299 . . . . 0.0 107.922 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -81.66 -10.29 59.44 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.695 -1.139 . . . . 0.0 109.788 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 59.97 31.34 72.15 Favored Glycine 0 C--N 1.34 0.773 0 CA-C-N 115.013 -0.994 . . . . 0.0 113.757 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -115.42 -11.72 11.81 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 121.531 0.681 . . . . 0.0 111.15 -173.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.424 ' H ' ' CG ' ' A' ' 129' ' ' ASP . . . 94.81 14.78 48.34 Favored Glycine 0 C--N 1.304 -1.201 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -177.081 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -143.71 124.51 14.22 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.552 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.9 OUTLIER -88.79 112.86 24.62 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.88 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.988 179.203 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.403 ' HA ' ' O ' ' A' ' 98' ' ' GLY . 48.4 m-80 -81.84 160.99 23.37 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.939 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.441 ' O ' HG13 ' A' ' 142' ' ' VAL . 71.7 t80 -57.24 -42.36 81.3 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.692 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -62.22 -21.58 65.25 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -87.87 -44.91 10.72 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -62.97 -38.45 91.16 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.376 -1.284 . . . . 0.0 112.609 -177.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.489 HG12 HG21 ' A' ' 85' ' ' ILE . 25.5 m -57.14 -30.43 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-O 121.18 0.515 . . . . 0.0 111.982 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -79.28 -26.38 42.35 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 121.495 0.664 . . . . 0.0 111.178 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 85.5 mtp -80.06 -19.13 48.26 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.898 -175.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.438 ' HG2' ' CD1' ' A' ' 85' ' ' ILE . 58.4 tpp . . . . . 0 C--N 1.32 -0.702 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 82' ' ' LYS . . . . . 0.504 ' HE3' ' OE1' ' B' ' 83' ' ' GLU . 2.9 tmmm? . . . . . 0 N--CA 1.446 -0.632 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 83' ' ' GLU . . . . . 0.504 ' OE1' ' HE3' ' B' ' 82' ' ' LYS . 11.9 mm-40 -65.9 -26.85 67.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.521 0.201 . . . . 0.0 111.326 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.72 -56.07 26.46 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 172.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.491 ' O ' HG12 ' B' ' 89' ' ' ILE . 60.4 m95 -61.51 -42.55 98.98 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.186 176.243 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 86' ' ' LYS . . . . . 0.403 ' HG2' ' OE1' ' B' ' 83' ' ' GLU . 19.0 tptm -49.0 -55.18 12.72 Favored 'General case' 0 CA--C 1.501 -0.904 0 C-N-CA 125.424 1.49 . . . . 0.0 110.057 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -63.42 -46.43 86.39 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.305 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.16 -52.52 65.35 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 123.538 0.524 . . . . 0.0 112.387 -177.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.491 HG12 ' O ' ' B' ' 85' ' ' TRP . 29.3 pt -68.92 -29.18 42.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.129 0.49 . . . . 0.0 111.225 -177.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 90' ' ' GLN . . . . . 0.41 ' OE1' ' HD3' ' A' ' 75' ' ' LYS . 8.2 tt0 -78.25 -42.77 30.1 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.652 -179.084 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 12.0 tppt? -55.28 -37.65 67.58 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.063 1.345 . . . . 0.0 109.235 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 92' ' ' ALA . . . . . 0.428 ' HB2' HG11 ' A' ' 91' ' ' VAL . . . -63.43 -31.49 72.66 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.54 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 94.5 mttt . . . . . 0 N--CA 1.433 -1.308 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.638 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.454 ' HB3' HD11 ' A' ' 9' ' ' ILE . 11.4 tp . . . . . 0 N--CA 1.421 -1.905 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.48 ' O ' HG13 ' A' ' 9' ' ' ILE . 34.5 p -86.76 143.52 27.48 Favored 'General case' 0 N--CA 1.42 -1.929 0 C-N-CA 123.214 0.606 . . . . 0.0 110.811 -177.047 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -52.19 -46.76 65.68 Favored 'General case' 0 C--O 1.244 0.786 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -174.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -60.32 -46.32 90.29 Favored 'General case' 0 CA--C 1.512 -0.488 0 O-C-N 123.269 0.356 . . . . 0.0 110.548 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.408 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 23.0 tp60 -66.13 -37.84 86.7 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.659 -178.051 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.503 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 30.5 mt -63.5 -43.01 98.17 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.0 177.324 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.79 -41.83 91.47 Favored 'General case' 0 C--O 1.259 1.584 0 CA-C-O 121.399 0.618 . . . . 0.0 110.935 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -60.68 -43.82 97.25 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.126 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.416 ' CZ ' ' HG3' ' A' ' 72' ' ' MET . 19.4 m-85 -62.92 -40.83 98.8 Favored 'General case' 0 C--O 1.168 -3.234 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.984 175.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -47.99 -52.54 19.41 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.388 0.613 . . . . 0.0 111.987 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -66.75 -48.14 70.02 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.0 -177.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.05 -31.53 69.19 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.434 0.635 . . . . 0.0 111.902 -177.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -65.41 -40.3 93.21 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 124.591 1.156 . . . . 0.0 109.702 177.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 26.1 m -69.87 -25.51 63.75 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.066 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -70.89 -43.19 68.86 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -66.04 -43.05 88.65 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.339 178.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -69.76 101.27 1.66 Allowed 'General case' 0 C--N 1.313 -1.017 0 O-C-N 123.947 0.779 . . . . 0.0 109.848 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -77.19 1.92 16.98 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -109.44 -13.78 14.53 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 175.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.39 24.54 73.67 Favored Glycine 0 N--CA 1.437 -1.234 0 CA-C-N 114.608 -1.178 . . . . 0.0 112.164 -176.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -98.95 -18.54 17.78 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 119.572 -0.851 . . . . 0.0 112.205 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.25 29.73 7.77 Favored Glycine 0 C--N 1.307 -1.033 0 C-N-CA 120.677 -0.773 . . . . 0.0 114.603 175.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.8 p -145.43 129.86 17.81 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 173.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 51.6 mt -101.7 115.45 43.51 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.987 -177.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.9 p -84.66 178.01 7.83 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.522 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.7 p -64.83 -29.25 70.2 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.475 0.655 . . . . 0.0 109.55 176.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -59.23 -57.85 11.2 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.772 177.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -64.48 -39.4 93.73 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 114.265 -1.334 . . . . 0.0 111.093 -177.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.5 mt -56.17 -57.5 11.91 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 123.373 0.421 . . . . 0.0 110.548 175.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.72 -31.31 79.66 Favored Glycine 0 C--O 1.211 -1.285 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.366 -178.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.9 m -69.13 -46.99 66.26 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 116.839 0.32 . . . . 0.0 110.825 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 28.4 m -70.69 -28.64 34.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 121.306 0.575 . . . . 0.0 110.755 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.532 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 22.2 mtt -68.81 -40.81 79.35 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 173.143 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -66.35 -30.57 71.0 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 123.851 0.86 . . . . 0.0 110.891 178.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.7 m -64.53 -25.95 68.21 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.462 0.649 . . . . 0.0 110.132 176.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -106.34 13.92 28.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.023 178.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.1 34.65 41.01 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 115.386 0.914 . . . . 0.0 115.386 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.459 ' C ' HD22 ' A' ' 42' ' ' ASN . 4.8 tt0 -131.22 129.84 42.15 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 118.295 1.047 . . . . 0.0 109.853 176.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.459 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.82 86.02 45.36 Favored Pre-proline 0 C--N 1.305 -1.347 0 O-C-N 122.126 -0.359 . . . . 0.0 110.489 176.75 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.532 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 16.6 Cg_exo -70.02 163.62 37.82 Favored 'Trans proline' 0 C--O 1.246 0.905 0 C-N-CA 122.992 2.461 . . . . 0.0 111.96 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.505 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 44.0 p -73.85 142.96 46.06 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 174.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -72.13 -19.08 61.84 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.034 -174.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.83 -39.72 92.8 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.095 174.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.505 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 37.8 mm-40 -65.14 -42.54 93.71 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 69.9 mt -65.89 -40.55 91.65 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.82 -1.082 . . . . 0.0 112.983 -175.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 64.4 tp60 -63.29 -44.96 93.56 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.82 177.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -64.16 -38.04 89.61 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.984 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 38.4 tpp -60.11 -50.89 71.91 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.977 -1.011 . . . . 0.0 109.798 178.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.8 mt -60.79 -51.79 69.1 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.483 177.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.407 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 12.2 t30 -63.92 -13.4 45.29 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -173.2 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -72.28 -40.99 67.2 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.599 HG11 ' HB2' ' A' ' 71' ' ' MET . 22.0 m -97.24 -21.98 5.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.211 -176.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 34.9 t0 -72.36 112.08 8.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.299 -179.089 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.51 -27.12 24.2 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-O 121.194 0.521 . . . . 0.0 110.914 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.33 -11.81 31.5 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -174.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.52 58.68 12.67 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.414 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -102.88 -16.83 15.77 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.2 23.35 34.91 Favored Glycine 0 N--CA 1.419 -2.451 0 N-CA-C 108.83 -1.708 . . . . 0.0 108.83 -173.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 49.4 p -140.35 137.13 33.84 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-N 115.567 -0.316 . . . . 0.0 111.039 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 57.5 mt -91.03 104.77 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.538 0 N-CA-C 104.269 -2.493 . . . . 0.0 104.269 173.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -84.0 168.17 16.2 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.553 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 57.8 t80 -52.87 -56.01 27.61 Favored Pre-proline 0 CA--C 1.554 1.128 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -175.251 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.75 -39.79 75.95 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 122.621 2.214 . . . . 0.0 112.547 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -70.38 -37.6 74.57 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.309 0.576 . . . . 0.0 110.056 -177.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -62.76 -41.97 99.47 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 72.2 mt -62.24 -49.28 76.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.014 178.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.1 m -56.87 -42.8 80.44 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.356 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.599 ' HB2' HG11 ' A' ' 55' ' ' VAL . 32.1 ttp -58.76 -46.68 86.9 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.165 0.586 . . . . 0.0 111.689 178.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.416 ' HG3' ' CZ ' ' A' ' 12' ' ' PHE . 23.2 mmt -71.76 -37.39 70.5 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.716 -177.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.31 -43.19 99.4 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -63.39 -28.94 70.33 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.69 176.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -69.01 -38.3 79.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 62.9 mtt . . . . . 0 C--N 1.318 -0.802 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.51 179.226 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 . . . . . 0 C--O 1.222 -0.394 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -66.33 -50.11 64.71 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 120.839 0.352 . . . . 0.0 111.668 -172.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -84.68 -26.0 28.04 Favored 'General case' 0 CA--C 1.494 -1.186 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.991 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.404 HD12 ' HG2' ' A' ' 145' ' ' MET . 4.9 mm -72.79 -36.69 53.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.733 -175.051 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -73.13 -30.94 63.97 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 176.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -67.99 -46.18 72.01 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.93 -27.91 69.17 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.024 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -76.55 -46.3 26.96 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -57.48 -38.7 74.97 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.529 1.132 . . . . 0.0 111.43 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.594 ' O ' ' HE2' ' A' ' 94' ' ' LYS . 11.6 p -68.06 -19.85 25.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.754 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -96.19 -52.39 4.03 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.742 177.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -80.46 100.94 8.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.576 0.703 . . . . 0.0 111.073 -178.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.594 ' HE2' ' O ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -78.52 -24.04 45.97 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.487 -0.779 . . . . 0.0 113.081 -179.424 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.91 -13.89 52.37 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.556 -0.858 . . . . 0.0 110.523 -176.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.28 43.26 95.49 Favored Glycine 0 CA--C 1.499 -0.924 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 178.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -101.61 -19.27 15.52 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 120.951 0.405 . . . . 0.0 110.603 -174.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.96 11.52 60.1 Favored Glycine 0 C--N 1.314 -0.684 0 C-N-CA 119.517 -1.325 . . . . 0.0 111.366 -179.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.418 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 51.9 m-85 -140.93 130.74 24.31 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.426 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.0 mt -103.59 133.74 46.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.8 t -100.95 158.94 15.62 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.88 -42.56 76.83 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 177.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.18 -33.52 75.65 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.772 177.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.511 ' O ' ' HB3' ' A' ' 107' ' ' HIS . 4.2 tp10 -65.52 -49.44 68.98 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 174.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.552 ' O ' ' HG2' ' A' ' 109' ' ' MET . 22.0 mt -56.52 -48.23 77.66 Favored 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.4 -176.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.403 ' HB2' HG21 ' A' ' 121' ' ' VAL . 2.1 tmm_? -56.1 -43.96 78.57 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' HIS . . . . . 0.511 ' HB3' ' O ' ' A' ' 104' ' ' GLU . 6.8 t-80 -52.87 -55.71 21.15 Favored 'General case' 0 C--O 1.254 1.316 0 C-N-CA 123.996 0.918 . . . . 0.0 111.365 176.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.461 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.6 p -73.24 -33.51 41.64 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.641 0 C-N-CA 120.243 -0.583 . . . . 0.0 111.494 -176.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.552 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.2 mmt -64.87 -43.71 92.05 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 122.432 0.293 . . . . 0.0 111.279 -178.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.6 m -62.04 -35.5 78.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -73.04 -27.21 61.62 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.113 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 78.0 mt -89.14 -21.18 23.47 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.03 -0.419 . . . . 0.0 111.73 -177.433 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.51 20.27 13.81 Favored Glycine 0 C--N 1.312 -0.794 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.21 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.495 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 1.4 mp0 -100.32 110.68 22.91 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 123.476 0.71 . . . . 0.0 109.779 178.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -82.03 69.63 8.78 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 122.236 1.017 . . . . 0.0 111.591 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.607 HD13 ' SD ' ' A' ' 124' ' ' MET . 56.6 mt -101.85 139.32 37.65 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 177.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 40.2 p -84.58 171.33 12.55 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.38 -31.89 73.17 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -66.15 -51.21 60.05 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.813 177.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.556 ' O ' ' HG3' ' A' ' 124' ' ' MET . 29.0 tt0 -66.56 -42.87 86.41 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.877 -176.54 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.53 ' HA ' ' SD ' ' A' ' 124' ' ' MET . 23.1 m -66.12 -31.36 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 120.429 -0.509 . . . . 0.0 111.169 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -68.06 -38.86 82.92 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.484 0.659 . . . . 0.0 109.702 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -66.38 -32.41 73.77 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.335 175.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.607 ' SD ' HD13 ' A' ' 116' ' ' LEU . 92.6 mtp -63.58 -45.01 92.38 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 174.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.3 mm -57.58 -50.25 77.89 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.144 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.246 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 126' ' ' ARG . 15.2 ttp180 -59.28 -25.01 63.73 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 124' ' ' MET . 30.2 mm-40 -65.83 -48.88 70.16 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.974 0.416 . . . . 0.0 111.448 173.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -91.81 -23.45 19.7 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -173.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.498 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 30.2 t70 -72.8 96.28 2.04 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 176.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.0 mt -83.53 -53.08 12.1 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.559 -176.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -79.6 -9.66 59.66 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -173.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.498 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 81.37 55.91 3.12 Favored Glycine 0 C--N 1.307 -1.041 0 C-N-CA 120.746 -0.74 . . . . 0.0 113.482 173.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -104.37 -16.18 15.2 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 98.0 -5.01 61.25 Favored Glycine 0 CA--C 1.494 -1.247 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.418 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 80.3 mt-30 -143.59 127.08 16.88 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.426 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.7 OUTLIER -76.05 128.43 37.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 123.795 0.684 . . . . 0.0 112.769 -176.141 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.2 m-80 -83.83 162.28 20.63 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.429 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -64.89 -39.06 92.94 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.73 -21.7 63.44 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.552 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -88.18 -39.92 14.12 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -62.88 -42.83 99.91 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.835 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 27.6 m -62.07 -30.83 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-O 121.077 0.465 . . . . 0.0 111.132 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -48.88 31.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 25.7 ttt -60.54 -42.18 95.99 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.996 0.427 . . . . 0.0 110.765 178.294 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.404 ' HG2' HD12 ' A' ' 85' ' ' ILE . 41.2 tpp . . . . . 0 CA--C 1.545 0.757 0 C-N-CA 123.742 0.817 . . . . 0.0 112.362 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? . . . . . 0 N--CA 1.441 -0.883 0 CA-C-O 121.657 0.741 . . . . 0.0 109.165 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.28 -26.26 64.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.689 -176.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.13 95.5 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.571 ' O ' HG12 ' B' ' 89' ' ' ILE . 86.0 m95 -65.75 -48.56 71.44 Favored 'General case' 0 CA--C 1.496 -1.097 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.063 176.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -55.93 -45.14 78.85 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 124.003 0.814 . . . . 0.0 110.771 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 27.0 m80 -61.72 -56.93 14.38 Favored 'General case' 0 C--O 1.206 -1.204 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.033 176.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.43 -51.85 63.64 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.635 ' O ' ' HE3' ' B' ' 93' ' ' LYS . 37.8 pt -62.57 -43.3 98.32 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.164 -177.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 90' ' ' GLN . . . . . 0.413 ' HG3' HG13 ' B' ' 89' ' ' ILE . 27.6 mt-30 -71.78 -42.98 66.48 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.0 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.495 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 21.4 tptm -56.37 -44.49 80.2 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 125.035 1.334 . . . . 0.0 111.587 178.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 92' ' ' ALA . . . . . 0.532 ' HB1' HG21 ' A' ' 91' ' ' VAL . . . -63.22 -32.93 74.46 Favored 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.637 -178.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.635 ' HE3' ' O ' ' B' ' 89' ' ' ILE . 8.5 mtmp? . . . . . 0 C--N 1.312 -1.043 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -174.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.41 ' HB3' HD11 ' A' ' 9' ' ' ILE . 12.8 tp . . . . . 0 N--CA 1.439 -0.989 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.7 p -90.12 143.82 26.44 Favored 'General case' 0 C--N 1.303 -1.42 0 C-N-CA 122.877 0.471 . . . . 0.0 111.718 -178.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 2.4 mp0 -46.54 -55.12 8.06 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 125.606 1.562 . . . . 0.0 113.342 -175.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -61.39 -40.8 95.68 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.188 0.595 . . . . 0.0 111.074 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.44 ' O ' ' HD2' ' A' ' 12' ' ' PHE . 6.3 tp-100 -65.81 -41.65 91.61 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.494 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 69.4 mt -63.33 -35.61 72.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.556 177.059 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.92 -39.12 87.29 Favored 'General case' 0 C--O 1.257 1.449 0 CA-C-O 121.093 0.473 . . . . 0.0 110.576 177.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -60.22 -48.38 81.98 Favored 'General case' 0 C--O 1.247 0.945 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 175.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.44 ' HD2' ' O ' ' A' ' 8' ' ' GLN . 28.2 m-85 -56.6 -46.52 80.82 Favored 'General case' 0 C--O 1.184 -2.393 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.727 175.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 33.9 mmtp -46.82 -49.83 19.38 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.501 0.721 . . . . 0.0 112.073 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -65.51 -57.27 8.64 Favored 'General case' 0 C--O 1.255 1.379 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.074 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.519 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -68.15 -28.54 67.39 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.806 -175.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.8 -42.58 99.19 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 123.176 0.59 . . . . 0.0 109.78 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.4 m -72.59 -18.23 61.62 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.111 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.519 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 62.8 tp -68.9 -42.18 77.23 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.099 0.475 . . . . 0.0 110.198 172.705 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -78.95 -35.97 42.37 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.143 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -77.17 99.32 5.38 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.683 175.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -74.42 -3.08 28.4 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.331 -0.85 . . . . 0.0 113.277 -174.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.415 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 21.6 m-20 -110.95 -13.26 14.14 Favored 'General case' 0 CA--C 1.49 -1.363 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.729 -179.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.41 23.18 68.23 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 -176.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.415 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 3.9 p-10 -97.25 -16.36 20.39 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.891 0.377 . . . . 0.0 110.044 -173.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 101.98 8.35 45.17 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 114.851 0.701 . . . . 0.0 114.851 176.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.4 p -130.53 136.55 49.05 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 118.471 1.136 . . . . 0.0 109.628 177.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.1 mt -102.89 114.64 43.05 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 176.243 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.0 p -87.12 172.24 10.1 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.469 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.8 p -65.79 -32.83 74.58 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.128 0.489 . . . . 0.0 110.218 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -62.43 -45.95 90.76 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.589 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -66.6 -41.65 88.09 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.74 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.444 ' HB3' ' SD ' ' A' ' 36' ' ' MET . 89.7 mt -55.64 -62.1 1.91 Allowed 'General case' 0 CA--C 1.501 -0.929 0 O-C-N 124.006 0.816 . . . . 0.0 109.874 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -59.4 -29.12 65.75 Favored Glycine 0 C--O 1.2 -1.974 0 C-N-CA 121.18 -0.533 . . . . 0.0 113.422 -175.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.1 m -73.61 -46.2 48.4 Favored 'General case' 0 CA--C 1.554 1.128 0 CA-C-N 117.606 0.703 . . . . 0.0 111.354 178.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.97 -28.21 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 121.771 0.796 . . . . 0.0 109.97 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.444 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 48.3 mtp -77.68 -28.73 51.16 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.344 177.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 80.3 ttt180 -68.57 -29.08 67.55 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 176.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.0 m -65.2 -35.45 81.1 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.157 173.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -82.65 -22.44 34.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.142 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.74 25.02 5.59 Favored Glycine 0 N--CA 1.435 -1.414 0 C-N-CA 120.816 -0.706 . . . . 0.0 114.236 178.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.417 ' HG2' ' HD3' ' A' ' 43' ' ' PRO . 42.7 tt0 -139.53 122.6 16.8 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 118.105 0.953 . . . . 0.0 109.476 176.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -141.11 89.85 9.52 Favored Pre-proline 0 C--N 1.298 -1.64 0 CA-C-O 121.71 0.766 . . . . 0.0 111.334 174.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.417 ' HD3' ' HG2' ' A' ' 41' ' ' GLN . 22.2 Cg_endo -75.95 172.42 16.31 Favored 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.785 2.324 . . . . 0.0 112.126 178.204 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 p -73.07 164.33 26.85 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.941 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -52.76 -46.81 67.67 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.802 1.241 . . . . 0.0 111.095 -176.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.46 -43.4 83.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.289 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -64.19 -43.14 95.97 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.25 0.548 . . . . 0.0 110.546 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.2 mt -68.55 -47.08 67.77 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.76 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -58.67 -46.1 87.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.47 0.653 . . . . 0.0 109.531 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -62.57 -30.86 71.63 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.6 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 34.9 tpp -83.04 -39.51 21.14 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.9 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.406 HG22 ' HB2' ' A' ' 56' ' ' ASP . 42.4 mt -57.74 -42.98 83.0 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 176.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -56.05 -18.42 9.54 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 124.272 1.029 . . . . 0.0 113.546 -177.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -70.14 -43.76 70.25 Favored 'General case' 0 N--CA 1.393 -3.323 0 O-C-N 121.667 -0.646 . . . . 0.0 110.717 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.575 HG11 ' HB2' ' A' ' 71' ' ' MET . 12.2 m -95.29 -25.29 4.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.202 0.525 . . . . 0.0 110.095 -177.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.406 ' HB2' HG22 ' A' ' 52' ' ' ILE . 25.9 t0 -67.86 115.94 7.96 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.776 -176.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.12 -27.99 57.29 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.155 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -94.55 -12.45 27.55 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -174.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.03 37.56 63.36 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -173.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.5 p-10 -104.04 -7.58 20.19 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -171.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.78 23.18 11.08 Favored Glycine 0 C--N 1.307 -1.052 0 C-N-CA 120.195 -1.002 . . . . 0.0 113.818 172.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.55 132.66 21.61 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 116.819 0.31 . . . . 0.0 110.484 177.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 52.6 mt -92.39 110.05 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 176.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -85.34 178.43 7.47 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.401 ' CE2' HD11 ' A' ' 69' ' ' LEU . 67.1 t80 -63.07 -54.79 43.04 Favored Pre-proline 0 C--N 1.298 -1.649 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -174.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -52.11 -40.05 69.38 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.616 2.21 . . . . 0.0 112.654 175.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -66.12 -40.85 90.99 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.4 0.619 . . . . 0.0 109.795 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -64.18 -40.88 97.05 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.94 177.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.401 HD11 ' CE2' ' A' ' 65' ' ' PHE . 81.1 mt -61.05 -48.45 81.68 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.56 176.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.6 m -56.92 -44.66 82.65 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 123.427 0.454 . . . . 0.0 110.257 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.575 ' HB2' HG11 ' A' ' 55' ' ' VAL . 30.5 ttp -56.99 -44.68 82.98 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.4 mmt -85.8 -32.54 21.73 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 119.086 -1.046 . . . . 0.0 112.52 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.26 -40.42 97.37 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 74' ' ' ARG . 2.5 ptm180 -66.07 -26.21 67.39 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 121.848 0.832 . . . . 0.0 110.364 178.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -87.28 -28.99 21.97 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 114.626 -1.17 . . . . 0.0 109.389 -176.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.3 ttm . . . . . 0 C--N 1.319 -0.726 0 CA-C-N 114.53 -1.213 . . . . 0.0 111.479 -177.822 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.44 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 2.1 mp0 . . . . . 0 C--O 1.211 -0.952 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 45.0 mt-10 -65.06 -59.56 4.0 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -52.93 -39.75 63.09 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.257 1.027 . . . . 0.0 109.496 176.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.4 mm -67.63 -51.26 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-N 113.376 -1.738 . . . . 0.0 110.354 -173.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 42.8 ttm105 -71.92 -30.99 65.92 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.338 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 47.6 mt-10 -61.28 -44.77 96.67 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.501 0.667 . . . . 0.0 110.181 174.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.46 -34.17 75.47 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.347 178.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -66.89 -50.32 62.84 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.946 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -66.43 -19.72 65.87 Favored 'General case' 0 N--CA 1.419 -1.998 0 C-N-CA 123.454 0.702 . . . . 0.0 112.767 -176.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.4 p -83.15 -28.72 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 C-N-CA 118.724 -1.191 . . . . 0.0 111.006 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -83.52 -48.19 10.54 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 177.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -75.87 105.33 6.85 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 175.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -77.88 -16.98 57.84 Favored 'General case' 0 C--N 1.288 -2.093 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -169.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -115.01 -13.06 11.91 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 120.262 -0.575 . . . . 0.0 111.939 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.83 55.75 5.22 Favored Glycine 0 N--CA 1.437 -1.262 0 N-CA-C 108.327 -1.909 . . . . 0.0 108.327 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -100.69 -18.47 16.51 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.065 0.46 . . . . 0.0 110.44 -174.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.64 11.99 59.99 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.256 -1.137 . . . . 0.0 110.256 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -147.46 130.59 16.4 Favored 'General case' 0 CA--C 1.498 -1.024 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -176.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.47 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.4 mt -104.74 132.63 50.99 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 175.298 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.3 p -109.82 160.09 16.65 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.481 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.84 -46.34 82.35 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -175.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.5 98.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.181 0.515 . . . . 0.0 109.87 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -61.62 -40.13 93.77 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.518 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 121' ' ' VAL . 4.0 tt -61.56 -43.55 98.65 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.639 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.594 ' HG3' HG21 ' A' ' 121' ' ' VAL . 31.0 mtm180 -60.89 -40.49 93.22 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 121.249 -0.181 . . . . 0.0 111.473 174.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -57.24 -50.82 71.68 Favored 'General case' 0 C--O 1.244 0.802 0 O-C-N 123.174 0.297 . . . . 0.0 111.523 178.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.2 p -68.6 -34.42 65.1 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 C-N-CA 119.819 -0.753 . . . . 0.0 110.06 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.458 ' HG3' HD12 ' A' ' 116' ' ' LEU . 23.3 mmt -65.7 -36.28 83.17 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 58.3 m -63.08 -36.9 85.13 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -69.12 -35.01 75.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.267 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 80.0 mt -87.5 -20.49 26.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -172.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 71.07 32.21 66.05 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 116.335 -0.393 . . . . 0.0 112.279 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -81.14 -25.12 37.13 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -178.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt 69.55 71.92 0.24 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.887 0.875 . . . . 0.0 111.0 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.458 HD12 ' HG3' ' A' ' 109' ' ' MET . 32.6 mt -118.61 130.58 55.96 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 37.8 p -83.47 174.09 10.92 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.909 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -57.12 -44.16 83.04 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 122.939 0.496 . . . . 0.0 111.013 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -55.57 -44.65 77.08 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 123.765 0.666 . . . . 0.0 111.251 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -69.52 -48.91 58.96 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.824 -175.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.594 HG21 ' HG3' ' A' ' 106' ' ' ARG . 7.3 m -67.88 -34.23 66.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.314 -177.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -69.87 -40.13 75.92 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.229 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 11.1 tp10 -65.62 -42.14 91.91 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 54.1 mtt -57.3 -50.91 71.43 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.65 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 121' ' ' VAL . 42.8 mm -56.01 -47.16 80.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -63.05 -29.97 71.23 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 123' ' ' GLU . 49.1 mt-10 -70.49 -42.42 71.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.016 0.436 . . . . 0.0 110.296 177.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.429 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -81.55 -33.38 31.74 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.22 -0.446 . . . . 0.0 112.01 -176.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -68.37 107.3 2.8 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 123.894 0.878 . . . . 0.0 109.975 177.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 68.9 mt -82.54 -42.41 18.38 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.752 -177.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -76.02 -11.79 60.01 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.007 0.432 . . . . 0.0 112.046 -174.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 68.84 46.98 58.15 Favored Glycine 0 N--CA 1.44 -1.063 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -99.61 -16.18 18.32 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 121.412 0.625 . . . . 0.0 110.51 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.22 -4.2 58.54 Favored Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.989 -0.624 . . . . 0.0 111.742 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -135.76 142.44 44.96 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.47 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.6 OUTLIER -100.28 126.57 53.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 O-C-N 123.595 0.559 . . . . 0.0 111.086 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -85.22 169.02 14.22 Favored 'General case' 0 CA--C 1.501 -0.908 0 O-C-N 123.679 0.612 . . . . 0.0 110.57 177.256 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.538 ' O ' HG13 ' A' ' 142' ' ' VAL . 92.0 t80 -60.14 -45.46 92.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.302 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.43 ' O ' HG22 ' A' ' 142' ' ' VAL . 4.1 mp0 -62.46 -29.95 70.9 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.695 0.798 . . . . 0.0 111.276 -179.072 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 47.4 mt-10 -82.57 -35.71 26.89 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.198 0.523 . . . . 0.0 109.736 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -69.4 -39.36 77.99 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.341 178.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.538 HG13 ' O ' ' A' ' 138' ' ' TYR . 19.5 m -58.58 -34.79 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-O 120.701 0.286 . . . . 0.0 110.524 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.6 tm0? -59.92 -40.86 90.3 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.364 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 70.2 mtp -86.38 -36.08 19.41 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 17.2 tpt . . . . . 0 C--N 1.314 -0.943 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.625 -177.098 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? . . . . . 0 N--CA 1.44 -0.936 0 CA-C-O 122.36 1.076 . . . . 0.0 109.14 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 83' ' ' GLU . . . . . 0.457 ' CD ' ' H ' ' B' ' 83' ' ' GLU . 11.8 mp0 -63.22 -49.01 75.86 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 113.209 -1.814 . . . . 0.0 108.787 178.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.27 -32.53 72.76 Favored 'General case' 0 C--O 1.192 -1.971 0 CA-C-N 115.187 -0.915 . . . . 0.0 112.09 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -64.01 -43.39 95.79 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-N 118.228 0.467 . . . . 0.0 111.74 177.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -62.82 -46.26 88.8 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -60.32 -44.51 95.4 Favored 'General case' 0 C--O 1.205 -1.245 0 CA-C-N 114.078 -1.419 . . . . 0.0 111.873 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.7 -54.41 47.43 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 123.579 0.752 . . . . 0.0 112.149 -178.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 35.3 pt -64.82 -32.21 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 121.289 0.566 . . . . 0.0 111.274 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -69.09 -51.58 37.16 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.336 177.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.408 ' HG3' ' HB3' ' A' ' 112' ' ' LEU . 4.1 tppp? -67.48 -45.19 76.6 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 123.443 0.697 . . . . 0.0 111.77 -178.243 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.59 -51.35 70.21 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.089 -176.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.401 ' HE2' ' HB3' ' B' ' 93' ' ' LYS . 51.3 mtpt . . . . . 0 C--N 1.318 -0.775 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.065 178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.541 HD23 HG12 ' A' ' 9' ' ' ILE . 12.3 tp . . . . . 0 N--CA 1.422 -1.826 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.1 p -78.2 143.52 37.09 Favored 'General case' 0 N--CA 1.421 -1.896 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.099 179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -55.73 -45.16 78.03 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.348 1.059 . . . . 0.0 112.512 -175.245 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.5 -41.18 96.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.023 0.44 . . . . 0.0 109.985 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -63.85 -42.51 97.56 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.846 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.578 HG22 ' HE3' ' A' ' 13' ' ' LYS . 65.4 mt -63.55 -37.38 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.991 176.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.68 -41.73 99.25 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.436 177.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -61.58 -44.19 97.48 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.608 175.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -59.53 -48.69 80.69 Favored 'General case' 0 C--O 1.197 -1.658 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.402 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE3' HG22 ' A' ' 9' ' ' ILE . 98.3 mttt -50.09 -43.87 51.72 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 122.966 0.506 . . . . 0.0 111.99 179.661 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.86 -59.44 3.29 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.405 -177.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.83 -33.6 75.09 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -175.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -63.51 -45.2 91.76 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 123.029 0.532 . . . . 0.0 110.029 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.8 m -74.11 -16.43 61.01 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.276 0.56 . . . . 0.0 110.966 178.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -79.13 -54.18 6.25 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.311 176.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -80.48 -20.73 43.04 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -174.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -67.81 101.08 1.01 Allowed 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 171.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -62.3 -7.7 4.71 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 116.083 1.883 . . . . 0.0 116.083 -171.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -109.95 -13.82 14.36 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.04 29.78 75.66 Favored Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.105 -176.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -104.34 -17.76 14.69 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.021 -0.671 . . . . 0.0 110.719 -176.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.95 4.16 63.45 Favored Glycine 0 N--CA 1.431 -1.693 0 C-N-CA 119.661 -1.257 . . . . 0.0 115.123 176.28 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.0 p -124.73 129.76 51.1 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 119.239 1.52 . . . . 0.0 109.582 170.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.9 mt -91.07 126.99 43.75 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.752 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.389 -174.047 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 p -102.57 167.01 10.2 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.15 173.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.8 p -53.73 -45.54 70.54 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 123.886 0.874 . . . . 0.0 113.005 -178.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -59.61 -34.98 73.45 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.495 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -70.35 -38.48 74.82 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.043 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.97 -47.87 84.46 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 175.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.44 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -64.28 -26.48 70.59 Favored Glycine 0 C--O 1.198 -2.151 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.473 179.245 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.7 m -68.99 -49.8 54.61 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 117.582 0.691 . . . . 0.0 110.565 179.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 30.4 m -70.62 -29.68 39.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.409 -0.516 . . . . 0.0 111.135 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtt -69.13 -42.86 75.46 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 40.5 ttm180 -56.3 -39.57 72.95 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.344 1.458 . . . . 0.0 109.461 178.011 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 m -65.58 -32.64 74.33 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.141 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 82.6 mt -87.97 -13.73 40.99 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.226 0.536 . . . . 0.0 110.275 178.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.74 47.11 2.36 Favored Glycine 0 N--CA 1.44 -1.064 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.783 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.43 ' HB2' ' HE2' ' B' ' 91' ' ' LYS . 50.1 tt0 -148.5 130.29 15.13 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 176.497 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -132.54 82.4 57.03 Favored Pre-proline 0 C--N 1.286 -2.175 0 C-N-CA 120.258 -0.577 . . . . 0.0 112.046 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -70.36 160.87 48.06 Favored 'Trans proline' 0 C--O 1.243 0.771 0 C-N-CA 122.581 2.187 . . . . 0.0 109.657 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.5 t -80.81 157.38 25.75 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.725 -176.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.82 -31.11 62.39 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.078 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.09 -42.66 95.13 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.726 0.298 . . . . 0.0 111.029 176.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 51' ' ' MET . 40.7 mt-10 -66.79 -43.25 84.44 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.459 0.647 . . . . 0.0 109.295 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 66.1 mt -64.31 -38.27 90.46 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.71 -178.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -66.33 -39.07 89.0 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.567 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.41 -38.99 88.69 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.677 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.408 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 24.4 mmt -60.83 -40.38 92.55 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.228 176.315 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.7 mt -66.19 -47.04 85.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.953 177.184 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.475 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.7 t30 -64.62 -12.61 47.45 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.797 -173.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -61.84 -40.17 94.36 Favored 'General case' 0 N--CA 1.392 -3.367 0 C-N-CA 123.861 0.864 . . . . 0.0 110.428 175.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.844 HG11 ' HB2' ' A' ' 71' ' ' MET . 19.3 m -112.21 -10.94 11.94 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.813 -178.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.475 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 24.3 t0 -73.53 103.23 4.08 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.371 0.605 . . . . 0.0 110.859 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.49 -11.12 49.89 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.023 -0.989 . . . . 0.0 111.693 -177.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -93.32 -11.49 32.29 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 119.869 -0.732 . . . . 0.0 110.566 -176.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 61.44 36.38 92.45 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -115.65 -12.14 11.6 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 122.732 -0.275 . . . . 0.0 110.967 -177.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.11 17.19 32.86 Favored Glycine 0 N--CA 1.434 -1.492 0 N-CA-C 115.373 0.909 . . . . 0.0 115.373 173.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.1 p -132.48 143.14 49.56 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-N 118.39 1.095 . . . . 0.0 111.49 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.9 mt -92.36 112.96 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -84.41 161.29 20.39 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 177.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.423 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 74.7 t80 -55.56 -50.04 89.22 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.685 0.394 . . . . 0.0 111.567 177.834 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.423 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 4.8 Cg_endo -49.68 -43.85 38.24 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 122.494 2.129 . . . . 0.0 112.671 173.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -71.78 -36.78 70.44 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.475 0.655 . . . . 0.0 110.045 -178.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -61.87 -43.82 98.06 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.751 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.1 mt -61.16 -45.45 94.6 Favored 'General case' 0 C--O 1.208 -1.131 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.269 178.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.5 m -57.12 -40.6 77.4 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 123.601 0.563 . . . . 0.0 110.536 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.844 ' HB2' HG11 ' A' ' 55' ' ' VAL . 27.5 ttp -55.51 -55.84 27.25 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.066 0.947 . . . . 0.0 112.143 -179.164 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -79.5 -38.55 34.13 Favored 'General case' 0 C--O 1.196 -1.711 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.26 -33.87 74.23 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -176.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -83.54 -19.17 36.15 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.896 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -83.07 -48.08 10.98 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . 0.262 1.8 ppp? . . . . . 0 N--CA 1.437 -1.115 0 CA-C-O 122.397 1.094 . . . . 0.0 113.388 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 . . . . . 0 C--O 1.205 -1.273 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 8.5 mm-40 -41.76 -59.6 1.62 Allowed 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 116.115 1.894 . . . . 0.0 116.115 -168.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -85.38 -24.78 27.41 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.908 0.861 . . . . 0.0 109.619 -175.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.45 HG23 ' HG2' ' A' ' 145' ' ' MET . 6.6 mm -73.46 -40.92 56.48 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.025 0 CA-C-N 114.436 -1.256 . . . . 0.0 108.762 -172.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -73.75 -26.67 60.78 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.855 178.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.565 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 43.1 mt-10 -64.02 -44.16 93.43 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 173.308 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -66.88 -37.01 83.6 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 114.552 -1.204 . . . . 0.0 110.803 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -72.18 -46.24 57.12 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.634 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.2 mtm180 -69.8 -18.28 63.46 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -177.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.475 HG12 ' O ' ' A' ' 88' ' ' ALA . 9.0 p -75.92 -20.57 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.037 178.44 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -97.0 -55.12 2.96 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -84.44 79.07 9.69 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.897 1.332 . . . . 0.0 109.367 176.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -78.59 -18.36 54.71 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 113.289 -1.778 . . . . 0.0 111.482 -176.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -91.33 -12.49 34.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.889 -177.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.83 45.79 49.74 Favored Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -94.86 -14.65 24.37 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.414 0.626 . . . . 0.0 109.967 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.18 8.09 82.22 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.552 177.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -142.95 138.95 30.48 Favored 'General case' 0 CA--C 1.491 -1.327 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -178.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.557 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.1 mt -97.56 124.98 50.8 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 174.314 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.6 m -102.02 150.53 23.13 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 123.831 0.707 . . . . 0.0 110.221 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.44 -45.06 81.1 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.74 -41.08 85.64 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 122.63 0.372 . . . . 0.0 110.752 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -59.15 -55.85 29.75 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.137 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.577 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.6 tt -59.93 -40.55 89.3 Favored 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.294 -172.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.448 ' HB2' HG21 ' A' ' 121' ' ' VAL . 0.0 OUTLIER -65.29 -38.87 91.57 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -63.07 -51.02 68.29 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.285 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.546 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -65.87 -31.51 54.06 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.38 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.371 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.577 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.4 mmt -62.55 -37.1 84.82 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 13.8 m -60.68 -46.55 89.92 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 175.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -69.08 -16.73 63.75 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 114.622 -1.172 . . . . 0.0 111.814 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 95.3 mt -100.9 -2.36 32.19 Favored 'General case' 0 C--N 1.316 -0.889 0 O-C-N 121.985 -0.447 . . . . 0.0 111.617 -177.218 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 81.02 1.24 89.84 Favored Glycine 0 C--O 1.237 0.301 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.466 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.436 ' HG3' ' SD ' ' A' ' 109' ' ' MET . 20.4 mm-40 -70.9 -48.69 52.32 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 52.08 73.47 0.32 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 124.519 1.137 . . . . 0.0 110.665 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.423 HD12 ' HG3' ' A' ' 109' ' ' MET . 82.1 mt -97.5 157.64 15.9 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.166 -177.549 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.4 p -76.82 158.64 30.7 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.497 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.407 ' HA ' HG22 ' A' ' 121' ' ' VAL . 3.9 p30 -67.84 -23.09 65.12 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-O 121.112 0.482 . . . . 0.0 109.892 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.81 -42.83 63.44 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 123.158 0.583 . . . . 0.0 110.375 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -68.22 -44.5 75.6 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.335 0.588 . . . . 0.0 109.863 -176.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.448 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.4 m -69.07 -29.58 43.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.143 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.84 -41.15 92.11 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.8 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -63.85 -43.51 95.94 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 55.4 mtt -53.89 -34.8 60.53 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.413 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.421 ' CG2' ' HA ' ' A' ' 135' ' ' GLN . 51.3 mm -86.23 -58.52 3.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.46 179.178 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.62 -38.35 86.75 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -171.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -70.15 -28.65 65.52 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.419 ' HA ' ' SD ' ' A' ' 144' ' ' MET . . . -80.18 -35.76 35.97 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.221 179.389 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.67 85.56 0.65 Allowed 'General case' 0 C--N 1.307 -1.276 0 CA-C-O 122.582 1.182 . . . . 0.0 112.424 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 28.9 mt -83.44 -8.74 11.41 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 CA-C-N 114.078 -1.419 . . . . 0.0 109.106 174.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.422 ' HB2' ' OE2' ' A' ' 140' ' ' GLU . 31.8 t70 -90.15 -12.47 38.11 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.607 -172.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.79 35.68 58.41 Favored Glycine 0 N--CA 1.433 -1.551 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.611 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -100.35 -16.87 17.5 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.444 0.64 . . . . 0.0 109.772 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.95 -2.28 85.53 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -176.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.421 ' HA ' ' CG2' ' A' ' 125' ' ' ILE . 21.9 mt-30 -138.37 147.29 43.27 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.634 1.173 . . . . 0.0 108.803 -178.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.557 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.4 p -86.69 121.11 37.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 C-N-CA 119.811 -0.756 . . . . 0.0 110.879 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -91.54 177.07 6.32 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.987 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.404 ' O ' HG13 ' A' ' 142' ' ' VAL . 85.5 t80 -70.05 -41.6 73.98 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.984 -173.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.411 ' HA ' HG22 ' A' ' 142' ' ' VAL . 44.7 mt-10 -63.94 -42.13 97.43 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.095 0.474 . . . . 0.0 111.408 -179.408 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.422 ' OE2' ' HB2' ' A' ' 131' ' ' ASP . 0.5 OUTLIER -70.48 -30.66 67.51 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.835 177.347 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -70.75 -45.37 64.94 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.054 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.411 HG22 ' HA ' ' A' ' 139' ' ' GLU . 23.9 m -62.45 -33.91 61.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-O 120.927 0.394 . . . . 0.0 110.828 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -60.9 -46.41 90.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.966 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.419 ' SD ' ' HA ' ' A' ' 128' ' ' ALA . 40.1 mtm -75.23 -40.17 59.29 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.693 -178.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.45 ' HG2' HG23 ' A' ' 85' ' ' ILE . 10.0 tpt . . . . . 0 C--N 1.32 -0.701 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.508 -175.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt . . . . . 0 C--O 1.247 0.947 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -80.26 -44.06 20.29 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.099 0.476 . . . . 0.0 110.147 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.84 -37.16 83.43 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.055 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.443 ' O ' HG13 ' B' ' 89' ' ' ILE . 48.2 m95 -57.56 -45.66 84.87 Favored 'General case' 0 C--O 1.206 -1.235 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 176.752 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -55.56 -49.51 72.48 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 122.512 1.149 . . . . 0.0 109.811 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -66.41 -36.6 83.25 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 113.149 -1.841 . . . . 0.0 111.195 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -77.44 -41.28 40.36 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.443 HG13 ' O ' ' B' ' 85' ' ' TRP . 83.1 mt -57.85 -50.99 75.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 122.943 0.497 . . . . 0.0 111.886 -178.169 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -68.18 -31.39 70.9 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.615 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' A' ' 112' ' ' LEU . 3.6 tppp? -65.99 -46.29 78.53 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.839 177.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.69 92.63 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.265 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 96.6 mttt . . . . . 0 N--CA 1.466 0.359 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.299 178.863 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.429 HD23 HG12 ' A' ' 9' ' ' ILE . 9.3 tp . . . . . 0 N--CA 1.442 -0.828 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.0 p -82.32 145.36 29.99 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -176.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -51.08 -50.59 58.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.812 1.245 . . . . 0.0 113.371 -176.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -66.72 -34.96 79.01 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.257 0.551 . . . . 0.0 110.705 -177.11 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.615 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 52.0 tp60 -74.36 -36.33 63.59 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.307 -178.039 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.429 HG12 HD23 ' A' ' 4' ' ' LEU . 68.8 mt -60.55 -40.67 85.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.939 176.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.93 -38.81 92.5 Favored 'General case' 0 C--O 1.255 1.376 0 CA-C-O 121.334 0.588 . . . . 0.0 110.647 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -62.88 -45.51 92.19 Favored 'General case' 0 C--O 1.249 1.059 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.255 177.081 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.615 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 23.1 m-85 -60.45 -38.75 85.17 Favored 'General case' 0 C--O 1.197 -1.667 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.837 178.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.479 ' HG2' ' CZ ' ' A' ' 65' ' ' PHE . 98.9 mttt -55.17 -51.12 67.51 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 121.026 0.441 . . . . 0.0 111.304 177.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -68.04 -46.85 69.99 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.291 -178.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.606 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -70.52 -21.87 62.69 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.995 -176.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -67.51 -53.56 27.54 Favored 'General case' 0 CA--C 1.486 -1.513 0 C-N-CA 123.41 0.684 . . . . 0.0 109.408 174.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 t -67.4 -16.82 64.45 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 121.018 0.437 . . . . 0.0 110.359 -177.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.606 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 16.7 tp -59.35 -46.84 87.52 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.56 172.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.628 ' HB2' HG11 ' A' ' 35' ' ' VAL . 25.2 p90 -101.42 -25.79 13.81 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.985 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -75.98 99.15 4.47 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 174.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -48.96 -34.52 13.11 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 116.767 2.136 . . . . 0.0 116.767 -170.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.1 p30 -110.47 -13.11 14.31 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 27.58 73.66 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.813 -0.232 . . . . 0.0 112.851 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -81.65 -16.48 51.26 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.165 0.507 . . . . 0.0 110.952 -176.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.43 0.26 46.83 Favored Glycine 0 N--CA 1.434 -1.442 0 C-N-CA 120.657 -0.783 . . . . 0.0 114.252 -178.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.446 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 67.2 p -128.89 129.4 45.48 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 118.898 1.349 . . . . 0.0 109.955 173.508 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.6 mt -89.38 111.97 23.68 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 179.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.6 p -87.74 170.04 11.58 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.993 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.3 p -63.02 -33.57 75.71 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 123.019 0.2 . . . . 0.0 110.852 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -52.61 -54.82 27.92 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.253 174.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.75 -45.04 79.86 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.188 -174.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 71.5 mt -60.17 -45.68 92.28 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 178.657 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.98 -29.04 67.52 Favored Glycine 0 C--O 1.207 -1.532 0 C-N-CA 118.997 -1.573 . . . . 0.0 112.188 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.8 m -69.57 -44.12 71.47 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 117.255 0.528 . . . . 0.0 110.436 177.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.628 HG11 ' HB2' ' A' ' 19' ' ' PHE . 25.1 m -66.76 -36.21 76.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-O 121.149 0.499 . . . . 0.0 109.949 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.533 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 63.2 mtt -68.46 -42.51 78.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.607 176.063 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 68.5 ttt180 -62.85 -25.59 68.35 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 123.873 0.869 . . . . 0.0 110.819 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.0 m -63.09 -30.25 71.45 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.349 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -98.05 9.34 43.07 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 120.9 0.381 . . . . 0.0 111.077 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.42 -9.7 75.54 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.767 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.401 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 62.1 tt0 -71.8 118.36 14.55 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -113.41 84.43 7.7 Favored Pre-proline 0 C--N 1.289 -2.052 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.533 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 73.1 Cg_endo -89.65 162.33 5.25 Favored 'Trans proline' 0 N--CA 1.434 -2.015 0 C-N-CA 122.409 2.072 . . . . 0.0 111.237 177.546 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.2 p -89.13 167.53 13.05 Favored 'General case' 0 C--N 1.283 -2.297 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 175.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -64.84 -30.21 71.2 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.54 89.35 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.708 0.289 . . . . 0.0 110.834 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -66.8 -38.47 86.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.535 0.683 . . . . 0.0 110.584 179.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.409 HD21 ' HG2' ' A' ' 43' ' ' PRO . 77.1 mt -68.67 -44.8 73.27 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.149 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -63.49 -34.88 78.75 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.718 -1.128 . . . . 0.0 109.847 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.22 -43.19 98.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.707 177.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 14.6 tpt -69.06 -36.31 77.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.373 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 67.8 mt -63.31 -55.76 21.22 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.367 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.43 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -57.9 -31.8 67.12 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 123.411 0.684 . . . . 0.0 112.007 -175.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.47 -31.88 66.39 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 123.955 0.902 . . . . 0.0 110.048 178.16 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.644 HG11 ' SD ' ' A' ' 71' ' ' MET . 32.9 m -114.89 -11.4 12.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 O-C-N 121.825 -0.547 . . . . 0.0 112.12 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -76.26 114.55 15.06 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 -174.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.85 -10.39 53.54 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.191 -178.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -106.99 -12.37 15.45 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.717 -176.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.78 44.8 94.05 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -175.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -115.37 0.83 13.56 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -174.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.02 23.6 37.67 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.191 -1.004 . . . . 0.0 113.86 173.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.446 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 1.7 p -150.73 142.05 23.3 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 116.981 0.391 . . . . 0.0 111.364 179.03 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.3 mt -97.97 104.19 15.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 175.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.56 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 6.7 t70 -78.84 164.81 24.18 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 -178.4 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.479 ' CZ ' ' HG2' ' A' ' 13' ' ' LYS . 61.3 t80 -52.68 -50.39 81.06 Favored Pre-proline 0 CA--C 1.554 1.112 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.56 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 4.8 Cg_endo -49.81 -49.6 15.51 Favored 'Trans proline' 0 C--N 1.364 1.375 0 C-N-CA 122.735 2.29 . . . . 0.0 112.019 172.184 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -63.05 -37.98 89.37 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.268 0.556 . . . . 0.0 109.753 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.417 ' O ' ' HG2' ' A' ' 72' ' ' MET . 39.7 t80 -64.33 -39.34 93.7 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.417 178.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.9 mt -66.55 -42.49 87.05 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.6 m -57.53 -45.29 85.2 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.644 ' SD ' HG11 ' A' ' 55' ' ' VAL . 42.6 ttp -64.94 -37.96 89.38 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.493 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 28.7 mmt -63.91 -43.3 96.36 Favored 'General case' 0 C--N 1.321 -0.674 0 O-C-N 122.259 -0.276 . . . . 0.0 110.863 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.97 -35.05 79.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.063 0.459 . . . . 0.0 109.895 176.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -69.88 -23.73 63.3 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.327 1.051 . . . . 0.0 110.749 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.459 ' HD3' ' O ' ' A' ' 71' ' ' MET . 4.1 mptp? -81.03 -20.41 41.76 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 121.888 -0.508 . . . . 0.0 111.377 177.377 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 21.5 ptp . . . . . 0 C--N 1.324 -0.521 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -171.871 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -58.29 -50.27 74.21 Favored 'General case' 0 C--O 1.205 -1.272 0 C-N-CA 123.4 0.68 . . . . 0.0 109.448 -178.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HA ' ' HB2' ' A' ' 87' ' ' GLU . 42.8 mm-40 -64.96 -29.29 70.21 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -178.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 30.0 mm -71.67 -47.28 58.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.0 ttm-85 -70.39 -30.08 66.89 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.87 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.422 ' HB2' ' HA ' ' A' ' 84' ' ' GLU . 7.5 mm-40 -56.47 -47.4 79.29 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.965 0.906 . . . . 0.0 112.162 174.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.48 94.86 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.091 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.18 -45.55 87.89 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-O 121.351 0.596 . . . . 0.0 109.51 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -56.34 -41.79 76.65 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 126.571 1.948 . . . . 0.0 111.987 -179.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.1 p -73.39 -27.06 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.118 -177.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -84.33 -60.06 2.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.647 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -79.59 81.86 5.79 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 121.981 0.896 . . . . 0.0 110.833 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -79.1 -38.43 36.24 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.493 -1.231 . . . . 0.0 111.987 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -73.55 -13.87 61.1 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 121.28 0.562 . . . . 0.0 111.036 -176.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.41 60.25 4.15 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.993 175.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 37.5 m-80 -99.33 -10.29 22.49 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.03 0.443 . . . . 0.0 110.755 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.82 1.88 84.73 Favored Glycine 0 CA--C 1.498 -0.982 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -153.5 150.13 28.43 Favored 'General case' 0 N--CA 1.412 -2.356 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.592 ' HB ' HG13 ' A' ' 136' ' ' VAL . 5.4 mt -98.55 124.36 51.66 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.114 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.1 m -101.59 159.04 15.64 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.388 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.08 -42.12 89.67 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.16 -44.3 89.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.295 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.635 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 3.1 tp10 -59.11 -46.76 87.48 Favored 'General case' 0 CA--C 1.494 -1.184 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.898 176.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.552 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.7 tt -62.3 -36.63 82.72 Favored 'General case' 0 N--CA 1.418 -2.039 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -174.377 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.2 -32.53 71.88 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.323 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' HIS . . . . . 0.635 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 48.0 m170 -53.49 -55.61 23.91 Favored 'General case' 0 C--O 1.26 1.658 0 CA-C-O 121.478 0.656 . . . . 0.0 110.117 177.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.421 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.7 p -65.79 -34.68 71.94 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.06 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.538 -178.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.552 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 19.8 mmt -62.13 -43.11 99.56 Favored 'General case' 0 CA--C 1.491 -1.324 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 m -59.43 -37.78 78.95 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.033 177.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -79.02 -22.91 44.75 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.2 177.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 93.0 mt -84.96 -20.0 31.27 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.778 0.323 . . . . 0.0 110.81 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 103.0 2.67 48.85 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.569 178.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -85.3 115.73 23.23 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.326 0.584 . . . . 0.0 111.279 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -85.8 76.13 9.95 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.454 HD12 ' HG3' ' A' ' 109' ' ' MET . 66.2 mt -101.14 147.54 26.13 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.011 -177.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.9 p -83.86 165.76 18.49 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.144 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -64.78 -39.28 93.35 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 1.5 mp0 -54.5 -49.71 69.52 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.169 176.631 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -59.4 -54.5 45.95 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.902 -176.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.456 ' O ' HG12 ' A' ' 125' ' ' ILE . 18.3 m -65.78 -35.79 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.378 -175.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.579 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 11.3 t70 -66.85 -42.06 86.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.357 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -69.92 -29.15 66.25 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.172 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.445 ' HE2' ' HB1' ' B' ' 84' ' ' ALA . 66.3 mtt -58.89 -49.66 76.95 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 173.48 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.9 mm -53.37 -46.44 58.07 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.603 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.661 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 27.5 mmt180 -62.07 -32.34 72.86 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -175.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -79.38 -35.89 40.09 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 120.1 -0.64 . . . . 0.0 111.241 178.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.464 ' HA ' ' HG2' ' A' ' 144' ' ' MET . . . -79.81 -21.36 44.36 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 121.706 0.765 . . . . 0.0 110.467 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -82.5 88.39 6.63 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.408 173.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 61.4 mt -81.85 -42.62 19.29 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -75.8 -9.29 58.47 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.8 53.84 3.86 Favored Glycine 0 N--CA 1.438 -1.213 0 C-N-CA 120.545 -0.836 . . . . 0.0 111.813 175.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -105.38 -10.35 17.03 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 90.72 -8.81 79.25 Favored Glycine 0 CA--C 1.499 -0.941 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.115 176.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -141.35 138.3 32.97 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.592 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.8 OUTLIER -81.78 114.67 23.06 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 N-CA-C 113.159 0.799 . . . . 0.0 113.159 -175.446 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -90.66 163.62 14.46 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.779 ' O ' HG23 ' A' ' 142' ' ' VAL . 47.4 t80 -55.5 -59.92 4.15 Favored 'General case' 0 C--O 1.198 -1.62 0 CA-C-O 117.96 -1.019 . . . . 0.0 113.165 -174.285 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -53.71 -37.15 62.99 Favored 'General case' 0 CA--C 1.561 1.399 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -172.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -73.95 -35.07 64.52 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 120.121 -0.631 . . . . 0.0 110.44 178.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -66.51 -41.74 88.4 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.182 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 138' ' ' TYR . 6.3 t -52.6 -43.03 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.424 0 C-N-CA 124.47 1.108 . . . . 0.0 109.841 177.573 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -66.82 -55.92 12.7 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.92 -178.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.464 ' HG2' ' HA ' ' A' ' 128' ' ' ALA . 3.1 ppp? -76.47 -20.45 56.99 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -174.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 C--O 1.242 0.689 0 CA-C-O 120.971 0.415 . . . . 0.0 110.117 175.537 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 82' ' ' LYS . . . . . 0.577 ' O ' ' HG3' ' B' ' 86' ' ' LYS . 13.0 mptt . . . . . 0 C--O 1.214 -0.798 0 CA-C-O 119.811 -0.138 . . . . 0.0 111.295 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.47 -36.97 85.9 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 174.082 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.445 ' HB1' ' HE2' ' A' ' 124' ' ' MET . . . -65.47 -46.21 80.68 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.508 175.446 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -61.65 -24.91 67.04 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 86' ' ' LYS . . . . . 0.624 ' HG2' ' OE1' ' B' ' 90' ' ' GLN . 67.1 mttm -68.79 -31.42 70.42 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.163 0.506 . . . . 0.0 110.549 175.682 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 87' ' ' HIS . . . . . 0.561 ' O ' ' HB3' ' B' ' 91' ' ' LYS . 74.8 m80 -84.07 -29.7 26.62 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.555 177.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -86.4 -63.15 1.36 Allowed 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -177.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 64.7 mt -81.57 -58.39 3.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 O-C-N 122.198 -0.314 . . . . 0.0 111.085 -173.263 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 90' ' ' GLN . . . . . 0.624 ' OE1' ' HG2' ' B' ' 86' ' ' LYS . 46.3 mt-30 -59.1 -36.06 74.5 Favored 'General case' 0 C--O 1.202 -1.421 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.163 -178.221 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.561 ' HB3' ' O ' ' B' ' 87' ' ' HIS . 20.3 tptp -80.67 -33.31 35.61 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.437 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.13 -46.44 77.51 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.571 0.7 . . . . 0.0 110.744 179.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.2 mmmt . . . . . 0 C--O 1.196 -1.727 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.937 -177.64 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 4' ' ' LEU . 11.1 tp . . . . . 0 N--CA 1.425 -1.691 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.9 p -74.68 142.84 44.44 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -67.25 -30.25 70.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -171.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -63.43 -40.09 96.24 Favored 'General case' 0 C--O 1.245 0.859 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 177.021 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.443 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 6.6 tp-100 -72.95 -36.32 67.15 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.376 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.47 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 64.7 mt -61.64 -37.84 78.88 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.945 176.317 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.1 -43.12 99.36 Favored 'General case' 0 C--O 1.256 1.408 0 CA-C-O 121.646 0.736 . . . . 0.0 110.371 176.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -60.62 -41.24 94.46 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.611 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.453 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 21.3 m-85 -74.96 -12.0 60.24 Favored 'General case' 0 C--O 1.189 -2.125 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 177.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 67.7 mttm -69.58 -48.81 58.92 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 173.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.72 -39.91 88.18 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 119.699 -0.8 . . . . 0.0 110.084 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.453 ' HB3' ' HA ' ' A' ' 12' ' ' PHE . . . -69.56 -24.14 63.66 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.409 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.578 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 70.1 t80 -68.52 -52.34 33.12 Favored 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 176.562 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 m -69.55 -16.69 63.47 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.15 -178.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.405 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 41.5 tp -62.78 -31.86 72.91 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 173.084 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.536 ' CD2' HG21 ' A' ' 35' ' ' VAL . 8.8 m-85 -98.29 -43.13 7.08 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.771 177.57 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -79.43 87.44 5.06 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 122.143 0.973 . . . . 0.0 109.222 176.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 27.5 mmmt -71.27 -26.22 62.8 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 114.046 -1.434 . . . . 0.0 112.358 -172.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.605 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 1.5 m-20 -90.98 -13.17 33.88 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.754 -177.273 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.46 58.41 9.46 Favored Glycine 0 C--O 1.223 -0.564 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.404 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.605 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 10.3 m-20 -112.12 -16.74 12.97 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -176.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.31 11.4 58.48 Favored Glycine 0 C--N 1.313 -0.722 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 -173.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.414 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 11.2 p -144.7 136.83 26.09 Favored 'General case' 0 N--CA 1.441 -0.925 0 C-N-CA 123.369 0.668 . . . . 0.0 110.167 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 56.9 mt -104.87 127.92 59.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 p -103.18 172.91 6.55 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.922 177.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.3 p -64.34 -27.98 69.4 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.881 0.372 . . . . 0.0 111.182 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -53.18 -54.01 42.12 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 124.553 1.141 . . . . 0.0 109.392 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.526 ' HB3' ' O ' ' A' ' 19' ' ' PHE . 35.1 mt-10 -71.2 -38.81 72.05 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 113.719 -1.582 . . . . 0.0 111.271 -174.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -59.32 -49.39 78.0 Favored 'General case' 0 C--O 1.208 -1.112 0 O-C-N 123.447 0.467 . . . . 0.0 110.907 176.487 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.13 -27.67 72.61 Favored Glycine 0 C--O 1.222 -0.613 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.465 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.2 m -65.7 -50.08 66.18 Favored 'General case' 0 C--O 1.262 1.739 0 CA-C-O 121.693 0.759 . . . . 0.0 109.591 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.697 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 34.8 m -73.35 -41.08 57.3 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.194 -178.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -48.12 75.61 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 123.166 0.587 . . . . 0.0 110.948 177.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -58.26 -39.56 79.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.943 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.8 m -68.63 -27.32 65.91 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 121.328 0.585 . . . . 0.0 111.164 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 52.3 mt -84.1 -20.27 32.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.324 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.22 19.02 40.43 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.4 ' C ' ' HD3' ' A' ' 43' ' ' PRO . 3.4 tp-100 -106.07 120.56 42.1 Favored 'General case' 0 N--CA 1.428 -1.573 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 -178.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -126.11 69.23 66.34 Favored Pre-proline 0 C--N 1.301 -1.539 0 C-N-CA 118.663 -1.215 . . . . 0.0 112.866 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.4 ' HD3' ' C ' ' A' ' 41' ' ' GLN . 5.7 Cg_exo -77.25 163.12 30.63 Favored 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 122.293 1.995 . . . . 0.0 109.875 175.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.426 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 22.8 p -75.29 161.77 29.01 Favored 'General case' 0 C--N 1.295 -1.804 0 CA-C-O 120.46 0.172 . . . . 0.0 111.163 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -57.39 -36.1 70.85 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 177.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.17 -49.69 76.13 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.464 178.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 8.1 mm-40 -64.22 -42.59 96.52 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.755 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.34 -45.72 89.92 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.557 0.535 . . . . 0.0 111.48 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.4 tm0? -66.63 -40.12 88.6 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -62.46 -38.06 88.36 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.978 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 21.7 mmt -58.49 -40.07 81.78 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.21 175.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.9 mt -67.28 -56.54 13.13 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.15 176.565 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.49 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.4 t30 -57.34 -26.2 60.61 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.488 0.715 . . . . 0.0 112.554 -173.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.57 -46.11 89.83 Favored 'General case' 0 N--CA 1.427 -1.621 0 C-N-CA 123.113 0.565 . . . . 0.0 109.503 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.604 HG11 ' SD ' ' A' ' 71' ' ' MET . 35.3 m -93.71 -19.77 6.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.274 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.49 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 44.8 t0 -67.89 106.84 2.43 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.184 -179.065 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.55 -9.71 53.65 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.582 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -101.71 -12.56 18.28 Favored 'General case' 0 CA--C 1.497 -1.088 0 C-N-CA 119.263 -0.975 . . . . 0.0 110.284 -173.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 61.23 39.09 96.7 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -172.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -108.14 -2.23 19.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.867 0.365 . . . . 0.0 110.963 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.52 9.14 82.07 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 121.088 -0.577 . . . . 0.0 114.308 172.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.414 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 26.2 p -134.88 150.94 50.52 Favored 'General case' 0 C--O 1.256 1.416 0 CA-C-N 117.5 0.65 . . . . 0.0 111.58 179.355 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 45.8 mt -91.88 106.64 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 176.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -77.16 163.86 26.19 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.421 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 48.5 t80 -52.01 -53.83 47.47 Favored Pre-proline 0 CA--C 1.561 1.377 0 O-C-N 123.681 0.613 . . . . 0.0 112.33 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -52.44 -38.49 74.16 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.988 2.459 . . . . 0.0 113.341 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -71.2 -43.37 67.53 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 121.243 0.544 . . . . 0.0 110.142 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.578 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 56.5 t80 -62.57 -41.77 99.14 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.455 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 91.4 mt -63.17 -49.49 74.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.749 177.445 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.7 m -57.75 -46.94 83.8 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.604 ' SD ' HG11 ' A' ' 55' ' ' VAL . 16.6 ptt? -67.72 -32.07 72.45 Favored 'General case' 0 CA--C 1.507 -0.692 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.374 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.1 tpp -71.22 -37.27 72.05 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.73 -30.11 71.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.613 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -75.41 -28.69 59.52 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.019 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 71' ' ' MET . 94.4 mttt -69.85 -29.75 67.07 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.062 -179.226 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 4.8 mpp? . . . . . 0 N--CA 1.448 -0.528 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 166.369 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 C--O 1.234 0.273 0 CA-C-O 121.182 0.515 . . . . 0.0 111.614 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -66.53 -46.32 76.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.681 -175.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -59.39 -43.68 92.91 Favored 'General case' 0 CA--C 1.501 -0.928 0 O-C-N 124.119 0.887 . . . . 0.0 110.666 -176.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.658 ' HA ' ' SD ' ' A' ' 145' ' ' MET . 7.0 mm -63.95 -49.64 80.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.574 -1.193 . . . . 0.0 109.302 -174.271 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -69.21 -33.43 73.31 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.969 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -63.74 -53.28 53.52 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.16 -46.01 91.13 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.787 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -60.44 -48.14 83.05 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.096 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.584 ' NE ' ' HA ' ' A' ' 90' ' ' ARG . 0.8 OUTLIER -60.23 -36.66 78.22 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.187 -178.169 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.7 p -75.89 -26.01 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 120.516 -0.474 . . . . 0.0 111.602 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -80.88 -56.32 4.2 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 176.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -88.9 86.15 6.89 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 122.009 0.909 . . . . 0.0 109.201 178.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -78.02 -21.6 50.51 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.249 -174.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.547 ' HB3' ' ND2' ' A' ' 97' ' ' ASN . 13.3 t70 -83.52 -15.13 50.56 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -177.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.509 ' HA2' ' NH2' ' A' ' 90' ' ' ARG . . . 72.06 51.18 14.98 Favored Glycine 0 N--CA 1.44 -1.057 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.804 179.628 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.547 ' ND2' ' HB3' ' A' ' 95' ' ' ASP . 39.6 m-80 -84.1 -19.61 33.96 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.832 0.348 . . . . 0.0 110.168 -178.216 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.68 -2.91 86.71 Favored Glycine 0 C--O 1.227 -0.319 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.432 ' CE1' ' HB2' ' A' ' 137' ' ' ASN . 91.9 m-85 -143.47 150.11 38.51 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.2 mt -111.36 133.16 57.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 177.219 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.2 m -98.7 156.96 16.57 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.69 -49.48 62.52 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -173.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.26 -33.75 76.73 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 36.3 tt0 -64.96 -46.97 79.33 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.469 176.508 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.471 HD21 ' SD ' ' A' ' 124' ' ' MET . 9.1 tt -65.31 -36.51 84.29 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.573 ' HA ' HG11 ' A' ' 121' ' ' VAL . 26.1 ttp180 -62.38 -38.44 89.6 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.322 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 104' ' ' GLU . 44.0 m170 -61.62 -54.2 46.02 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.067 176.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 6.3 p -61.98 -36.36 73.59 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.55 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.659 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.3 mmt -64.28 -41.41 96.92 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-O 121.011 0.434 . . . . 0.0 111.08 178.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.2 m -66.07 -33.88 76.79 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 178.058 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -75.1 -25.17 58.31 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.539 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.4 mt -87.93 -20.36 26.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.333 0.587 . . . . 0.0 110.721 -178.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.39 -14.06 43.29 Favored Glycine 0 C--N 1.305 -1.149 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.898 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.426 ' OE2' ' HG2' ' B' ' 91' ' ' LYS . 1.1 mp0 -61.85 -42.57 99.21 Favored 'General case' 0 CA--C 1.504 -0.825 0 C-N-CA 123.043 0.537 . . . . 0.0 110.053 177.249 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 54.5 35.83 24.28 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.454 1.096 . . . . 0.0 111.314 176.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.5 mt -57.95 143.31 43.41 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.246 -177.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 16.7 p -70.21 168.39 15.86 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 123.599 0.562 . . . . 0.0 110.539 178.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.52 ' HA ' HG22 ' A' ' 121' ' ' VAL . 11.4 t70 -62.81 -35.39 79.76 Favored 'General case' 0 C--O 1.215 -0.735 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -177.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -53.33 -54.58 34.44 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.546 1.138 . . . . 0.0 111.024 176.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -71.69 -38.37 70.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.118 -175.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.573 HG11 ' HA ' ' A' ' 106' ' ' ARG . 11.9 m -70.95 -33.94 53.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.891 -178.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -71.97 -36.36 69.79 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -60.96 -46.37 90.99 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 175.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.471 ' SD ' HD21 ' A' ' 105' ' ' LEU . 35.5 mtt -53.53 -50.45 65.45 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.735 175.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 121' ' ' VAL . 47.3 mm -63.2 -57.2 12.99 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.506 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.557 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -54.95 -42.23 72.07 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -171.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -74.67 -30.77 61.7 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 179.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.412 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -84.0 -27.28 28.53 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.339 0.59 . . . . 0.0 110.502 -179.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.442 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 7.7 t70 -67.66 96.17 0.53 Allowed 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 125.626 1.57 . . . . 0.0 109.419 175.123 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.1 mt -82.68 -48.49 17.88 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.836 -176.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.86 -11.3 60.88 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 121.137 0.494 . . . . 0.0 112.245 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.442 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 72.9 47.06 26.78 Favored Glycine 0 C--N 1.306 -1.105 0 N-CA-C 110.814 -0.914 . . . . 0.0 110.814 178.065 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -98.73 -16.41 18.98 Favored 'General case' 0 C--N 1.306 -1.309 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -178.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.1 10.39 61.15 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -147.77 134.17 19.64 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 124.729 1.212 . . . . 0.0 107.92 -176.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.405 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 0.7 OUTLIER -88.02 121.56 38.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 CA-C-O 120.564 0.221 . . . . 0.0 111.392 -179.491 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.432 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 20.5 t30 -85.77 154.47 21.58 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.304 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.543 ' O ' HG13 ' A' ' 142' ' ' VAL . 42.1 t80 -56.01 -47.55 77.57 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.336 1.054 . . . . 0.0 110.407 178.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.55 -21.62 66.74 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.696 -178.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.426 ' HG3' ' HB3' ' A' ' 137' ' ' ASN . 43.5 mt-10 -87.97 -42.9 12.15 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 122.027 0.917 . . . . 0.0 108.734 177.137 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -65.9 -28.26 68.81 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.1 -177.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.565 ' HA ' HG21 ' A' ' 85' ' ' ILE . 34.6 m -60.34 -29.15 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-O 121.085 0.469 . . . . 0.0 111.638 177.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -79.93 -44.97 19.38 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-O 121.578 0.704 . . . . 0.0 109.586 178.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.412 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 90.9 mmm -66.6 -44.22 82.69 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 114.866 -1.061 . . . . 0.0 112.653 -176.469 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.658 ' SD ' ' HA ' ' A' ' 85' ' ' ILE . 28.3 ttt . . . . . 0 C--N 1.317 -0.848 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -177.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 22.4 tptm . . . . . 0 N--CA 1.448 -0.546 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -60.99 -40.52 93.8 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.598 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.61 -49.75 69.86 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.801 -179.302 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.402 ' O ' HG12 ' B' ' 89' ' ' ILE . 64.8 m95 -59.71 -39.74 85.63 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.92 177.201 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -53.63 -59.78 4.16 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 122.004 0.907 . . . . 0.0 109.262 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -62.37 -38.0 87.87 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.158 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.08 -51.8 66.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.448 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.402 HG12 ' O ' ' B' ' 85' ' ' TRP . 26.9 pt -66.12 -34.24 68.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.736 -0.386 . . . . 0.0 111.789 -177.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -59.33 -43.89 92.67 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.139 0.495 . . . . 0.0 110.285 175.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.426 ' HG2' ' OE2' ' A' ' 114' ' ' GLU . 5.6 tppp? -75.02 -45.44 41.74 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.312 -178.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.13 -41.62 97.14 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -174.248 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp . . . . . 0 N--CA 1.474 0.768 0 CA-C-O 121.282 0.563 . . . . 0.0 110.389 178.541 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.497 HD23 HG12 ' A' ' 9' ' ' ILE . 6.0 tp . . . . . 0 N--CA 1.429 -1.52 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 16.7 p -74.64 154.18 38.62 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.515 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.7 mp0 -53.33 -45.23 68.99 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.546 0.738 . . . . 0.0 111.331 -175.146 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -66.3 -34.32 77.73 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.059 0.457 . . . . 0.0 110.685 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 61.9 tp60 -72.23 -36.17 69.05 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.417 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.497 HG12 HD23 ' A' ' 4' ' ' LEU . 62.7 mt -66.64 -34.59 71.07 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.852 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.667 175.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.61 98.91 Favored 'General case' 0 C--O 1.267 2.016 0 C-N-CA 123.128 0.571 . . . . 0.0 110.587 174.531 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 8' ' ' GLN . 42.6 mm-40 -55.64 -49.06 73.87 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 174.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -68.63 -25.9 65.07 Favored 'General case' 0 C--O 1.187 -2.224 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.311 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 32.9 mmtp -56.48 -56.89 15.59 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 175.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -71.15 -40.77 71.16 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.786 -177.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.13 -30.96 71.93 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.323 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -68.08 -44.48 76.19 Favored 'General case' 0 C--O 1.204 -1.315 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.6 m -63.35 -25.68 68.41 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 120.969 0.414 . . . . 0.0 111.509 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -67.17 -36.99 82.98 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.479 ' CD2' HG21 ' A' ' 35' ' ' VAL . 26.0 m-85 -88.17 -38.41 15.34 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.573 -179.048 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -78.2 99.39 6.21 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 176.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -77.93 -5.23 50.42 Favored 'General case' 0 C--N 1.287 -2.143 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.069 -173.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.639 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 4.1 m-20 -116.98 -13.72 10.63 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.51 53.98 25.49 Favored Glycine 0 CA--C 1.524 0.618 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.881 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.639 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 3.6 m-20 -110.66 -17.79 13.31 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 117.233 0.516 . . . . 0.0 110.241 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.38 21.08 39.09 Favored Glycine 0 N--CA 1.439 -1.165 0 N-CA-C 109.299 -1.521 . . . . 0.0 109.299 -173.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.3 p -146.7 130.98 17.49 Favored 'General case' 0 C--O 1.252 1.229 0 C-N-CA 123.87 0.868 . . . . 0.0 109.613 -178.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 75.1 mt -113.35 121.46 65.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.54 ' OG1' ' HB3' ' A' ' 30' ' ' LYS . 17.9 p -93.83 175.51 6.7 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.282 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.3 p -66.78 -26.58 67.03 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-O 121.316 0.579 . . . . 0.0 109.687 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.54 ' HB3' ' OG1' ' A' ' 28' ' ' THR . 35.4 tttm -49.56 -59.31 3.89 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.401 1.48 . . . . 0.0 109.107 171.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -71.61 -35.77 70.58 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.387 -174.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.5 mt -58.21 -52.04 67.23 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.58 0.55 . . . . 0.0 109.753 175.35 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.85 -30.13 76.52 Favored Glycine 0 C--O 1.216 -1.0 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.243 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.4 m -59.74 -53.37 58.75 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-O 120.897 0.38 . . . . 0.0 110.624 177.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.482 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 34.2 m -70.28 -34.32 58.02 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.369 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.93 -178.227 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.472 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 49.6 mtt -68.92 -34.94 76.2 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.969 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.0 ttp85 -60.31 -41.9 94.43 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -64.79 -32.3 73.93 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.741 176.325 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 90.4 mt -84.36 -5.43 59.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.422 -178.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.15 25.46 37.04 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 116.391 -0.368 . . . . 0.0 113.508 178.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -125.59 133.94 52.1 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -120.65 83.65 35.61 Favored Pre-proline 0 C--N 1.301 -1.507 0 O-C-N 122.226 -0.297 . . . . 0.0 110.513 176.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.472 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 6.1 Cg_exo -82.64 154.34 15.62 Favored 'Trans proline' 0 C--O 1.24 0.616 0 C-N-CA 123.121 2.547 . . . . 0.0 111.251 176.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.9 p -86.19 161.74 18.68 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -46.92 -58.96 3.42 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.894 1.678 . . . . 0.0 112.361 -175.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.49 -29.86 70.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 51' ' ' MET . 8.1 mm-40 -68.94 -45.29 71.14 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.1 mt -62.8 -41.2 99.17 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.616 -1.175 . . . . 0.0 109.323 177.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -56.1 -48.09 76.81 Favored 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 123.504 0.722 . . . . 0.0 111.269 176.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -63.66 -37.44 87.36 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 120.613 0.244 . . . . 0.0 111.016 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.499 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 28.1 mmt -59.59 -48.1 83.0 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.423 HG22 ' HB2' ' A' ' 56' ' ' ASP . 61.1 mt -61.04 -45.28 98.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.153 177.223 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -60.3 -14.84 20.36 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 125.108 1.363 . . . . 0.0 114.49 -176.104 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -69.76 -39.29 76.8 Favored 'General case' 0 N--CA 1.408 -2.534 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 177.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.717 HG11 ' HB2' ' A' ' 71' ' ' MET . 18.7 m -110.49 -15.86 9.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.028 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.742 -174.006 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.423 ' HB2' HG22 ' A' ' 52' ' ' ILE . 29.9 t0 -71.49 104.91 3.4 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -177.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.41 -26.6 24.65 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.173 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.73 -11.93 38.14 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -176.265 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 59.63 60.7 8.27 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.787 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -108.03 -17.36 14.06 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.81 23.51 38.63 Favored Glycine 0 N--CA 1.426 -1.986 0 N-CA-C 109.207 -1.557 . . . . 0.0 109.207 -172.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 57.3 p -139.14 136.11 34.77 Favored 'General case' 0 C--O 1.27 2.165 0 C-N-CA 122.593 0.357 . . . . 0.0 110.321 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.422 HG13 HG12 ' A' ' 52' ' ' ILE . 54.6 mt -91.7 104.7 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.127 0 N-CA-C 105.003 -2.221 . . . . 0.0 105.003 174.045 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -82.49 153.4 25.61 Favored 'General case' 0 C--N 1.285 -2.213 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 -176.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -45.08 -52.73 18.82 Favored Pre-proline 0 N--CA 1.487 1.4 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -176.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -49.54 -42.64 41.72 Favored 'Trans proline' 0 C--N 1.367 1.537 0 C-N-CA 122.842 2.361 . . . . 0.0 112.65 175.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -73.47 -34.09 65.19 Favored 'General case' 0 CA--C 1.508 -0.664 0 C-N-CA 122.884 0.473 . . . . 0.0 110.304 -178.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -62.8 -39.5 94.46 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.14 -47.47 79.83 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.858 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.4 m -57.64 -41.52 81.55 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.418 0.687 . . . . 0.0 110.281 178.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.717 ' HB2' HG11 ' A' ' 55' ' ' VAL . 31.5 ttp -57.58 -45.01 85.78 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.204 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 26.3 mmt -77.42 -38.88 48.72 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.508 -177.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.44 -46.48 88.62 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 123.35 0.407 . . . . 0.0 111.137 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 66.2 mtp180 -56.42 -31.64 64.1 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.602 0.715 . . . . 0.0 111.758 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -88.13 -25.81 22.8 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.459 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.2 ttp . . . . . 0 C--N 1.31 -1.136 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.699 -175.525 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.1 -46.23 90.3 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -175.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -67.52 -35.9 79.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.036 0.446 . . . . 0.0 110.882 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.9 mm -73.3 -41.68 57.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-O 121.952 0.882 . . . . 0.0 109.217 -176.584 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -74.25 -34.09 63.5 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.831 -178.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.17 -46.89 88.65 Favored 'General case' 0 CA--C 1.501 -0.905 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.446 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -56.37 -45.77 80.37 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 113.911 -1.495 . . . . 0.0 110.943 177.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -67.21 -45.84 75.64 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 119.739 -0.784 . . . . 0.0 110.863 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -67.07 -22.56 65.84 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -177.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 88' ' ' ALA . 8.1 p -78.88 -21.65 12.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 C-N-CA 119.771 -0.771 . . . . 0.0 110.067 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -94.47 -39.24 10.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.48 175.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -109.27 92.65 4.13 Favored 'General case' 0 C--O 1.245 0.823 0 CA-C-O 121.8 0.81 . . . . 0.0 109.589 174.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -51.47 9.73 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 114.06 -1.427 . . . . 0.0 111.899 -174.584 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -85.4 -12.37 52.24 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -171.032 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.23 55.12 1.75 Allowed Glycine 0 N--CA 1.432 -1.612 0 C-N-CA 119.771 -1.204 . . . . 0.0 110.997 177.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -83.21 -18.38 39.5 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.58 -15.54 40.71 Favored Glycine 0 CA--C 1.501 -0.803 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.595 175.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.622 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 73.0 m-85 -140.04 134.4 31.34 Favored 'General case' 0 N--CA 1.417 -2.079 0 N-CA-C 107.275 -1.379 . . . . 0.0 107.275 -179.11 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.417 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.0 mt -75.27 135.52 27.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.713 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 177.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.5 m -105.97 139.58 40.29 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -177.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.55 -47.7 80.52 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.613 0.598 . . . . 0.0 112.613 -175.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.6 -43.14 97.77 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.675 -178.29 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -66.09 -40.86 91.14 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.099 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.511 ' O ' ' HG2' ' A' ' 109' ' ' MET . 7.0 tt -62.59 -39.28 93.22 Favored 'General case' 0 C--O 1.215 -0.75 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.441 ' HG3' HG11 ' A' ' 121' ' ' VAL . 27.8 ttt180 -68.34 -30.37 69.31 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.305 0.574 . . . . 0.0 109.943 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -69.88 -45.04 68.55 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.736 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.585 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.7 p -64.59 -29.23 46.78 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.471 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.511 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 19.3 mmt -59.53 -49.61 77.13 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 177.529 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 23.0 m -60.09 -34.77 73.92 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 121.001 0.429 . . . . 0.0 110.061 177.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -70.77 -33.49 70.83 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.087 0.555 . . . . 0.0 110.906 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 72.6 mt -81.4 -8.17 59.69 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.335 0.588 . . . . 0.0 110.565 -178.519 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.36 19.45 30.2 Favored Glycine 0 N--CA 1.432 -1.612 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.996 179.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -98.55 177.02 5.46 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -151.28 48.07 0.83 Allowed 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.928 0.871 . . . . 0.0 109.162 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.413 HD12 ' HG3' ' A' ' 109' ' ' MET . 82.2 mt -76.16 143.99 40.83 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.186 -176.054 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 44.4 p -78.0 170.61 16.31 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.256 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.459 ' HA ' HG22 ' A' ' 121' ' ' VAL . 3.7 p-10 -70.17 -20.65 63.12 Favored 'General case' 0 C--O 1.206 -1.234 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.907 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -71.39 -45.05 63.78 Favored 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 123.485 0.491 . . . . 0.0 110.28 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -65.24 -45.3 85.18 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.964 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.459 HG22 ' HA ' ' A' ' 118' ' ' ASP . 12.8 m -72.57 -27.89 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.39 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.62 -46.29 79.84 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.664 174.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -64.1 -34.19 77.48 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.556 -177.476 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 65.2 mtt -57.7 -57.72 11.51 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.179 175.074 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.5 mm -61.56 -56.43 17.84 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.186 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.857 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 -53.01 -44.06 67.0 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 124.909 1.283 . . . . 0.0 113.285 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -87.06 -7.77 57.75 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.957 -175.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -95.43 -30.79 13.7 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 173.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -66.21 102.37 0.83 Allowed 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 125.772 1.629 . . . . 0.0 109.013 173.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.4 mt -81.76 -44.65 20.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.766 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.941 -174.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -73.73 -11.58 60.44 Favored 'General case' 0 C--O 1.243 0.717 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.43 44.72 20.87 Favored Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.51 -0.853 . . . . 0.0 111.252 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -98.03 -16.18 19.73 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.106 0.479 . . . . 0.0 110.126 -177.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.52 4.27 64.13 Favored Glycine 0 C--O 1.241 0.571 0 C-N-CA 120.463 -0.875 . . . . 0.0 111.107 -177.498 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.622 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 41.7 mt-30 -137.73 151.61 48.38 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.417 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.3 p -114.7 116.33 52.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 C-N-CA 119.898 -0.721 . . . . 0.0 112.893 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.431 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 27.9 t30 -75.55 157.57 33.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.311 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -50.52 -49.04 56.78 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.359 1.064 . . . . 0.0 110.726 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -64.02 -24.73 67.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.985 -177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -85.1 -42.21 15.01 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -63.25 -44.62 94.65 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.431 178.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.92 -30.19 49.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.68 0.276 . . . . 0.0 111.735 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -71.15 -44.06 66.31 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 121.614 0.721 . . . . 0.0 109.935 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 12.9 tmm? -75.41 -40.0 58.35 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.342 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.8 ttt . . . . . 0 C--N 1.325 -0.491 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -178.607 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 82' ' ' LYS . . . . . 0.407 ' HD3' ' HA ' ' B' ' 82' ' ' LYS . 56.3 mmtt . . . . . 0 CA--C 1.496 -1.127 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.76 -31.41 72.37 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 123.703 0.627 . . . . 0.0 109.346 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.79 -56.11 9.06 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.592 177.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 49.3 m95 -59.43 -42.05 90.97 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 86' ' ' LYS . . . . . 0.461 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.7 OUTLIER -52.43 -60.48 3.18 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.339 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -56.13 -47.7 77.65 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.506 -1.679 . . . . 0.0 111.159 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.66 -59.67 4.58 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 123.421 0.688 . . . . 0.0 112.81 -176.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 86.9 mt -54.51 -51.27 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 O-C-N 123.793 0.683 . . . . 0.0 111.839 -174.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 90' ' ' GLN . . . . . 0.415 ' OE1' ' HE2' ' B' ' 86' ' ' LYS . 49.1 mt-30 -62.66 -44.27 96.69 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.096 -174.522 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.461 ' HE3' ' HB2' ' B' ' 91' ' ' LYS 0.296 19.4 ptmt -81.62 -19.67 41.33 Favored 'General case' 0 C--O 1.21 -0.998 0 C-N-CA 119.256 -0.978 . . . . 0.0 113.447 179.627 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.37 -38.45 81.41 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.453 -0.779 . . . . 0.0 109.216 173.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? . . . . . 0 CA--C 1.545 0.755 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.601 178.786 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.566 HD23 HG12 ' A' ' 9' ' ' ILE . 14.2 tp . . . . . 0 N--CA 1.43 -1.43 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.606 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 38.2 p -72.67 142.9 48.26 Favored 'General case' 0 N--CA 1.427 -1.6 0 C-N-CA 119.223 -0.991 . . . . 0.0 108.864 176.439 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -71.58 -18.05 62.26 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 112.98 0.734 . . . . 0.0 112.98 -172.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -71.05 -36.52 72.34 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.606 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 6.8 mm100 -70.11 -39.89 75.22 Favored 'General case' 0 C--O 1.196 -1.743 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 177.094 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.566 HG12 HD23 ' A' ' 4' ' ' LEU . 32.0 mt -59.93 -39.11 79.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.039 176.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.88 -47.26 85.8 Favored 'General case' 0 C--O 1.246 0.914 0 C-N-CA 123.308 0.643 . . . . 0.0 111.064 176.073 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -63.46 -42.09 98.61 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.801 178.544 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.56 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 14.9 m-30 -65.37 -34.72 78.97 Favored 'General case' 0 C--O 1.187 -2.212 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.085 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 97.3 mttt -57.03 -43.45 81.89 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.245 0.341 . . . . 0.0 110.89 174.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -59.68 -61.15 2.83 Favored 'General case' 0 C--O 1.258 1.509 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.576 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.64 -26.56 67.86 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.797 -177.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.56 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 30.9 t80 -61.37 -47.6 85.11 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 123.332 0.653 . . . . 0.0 110.503 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.1 m -75.28 -16.93 60.4 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.164 0.507 . . . . 0.0 110.977 178.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.34 -36.64 79.56 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 172.117 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -84.25 -41.79 16.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.025 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -80.74 99.14 8.07 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -73.6 -1.68 19.8 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -116.75 -14.38 10.77 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 117.996 -1.482 . . . . 0.0 112.014 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.53 28.34 33.02 Favored Glycine 0 C--N 1.309 -0.929 0 C-N-CA 120.28 -0.962 . . . . 0.0 112.637 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -101.2 -17.44 16.62 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.197 0.523 . . . . 0.0 109.788 178.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.58 20.45 76.64 Favored Glycine 0 N--CA 1.437 -1.262 0 CA-C-N 115.537 -0.756 . . . . 0.0 114.733 176.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.6 p -132.04 128.69 38.82 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 171.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.7 mt -104.31 115.75 46.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.846 0 O-C-N 121.873 -0.517 . . . . 0.0 109.731 -174.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -83.61 173.35 11.48 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.043 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.1 p -61.87 -43.05 99.64 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 120.864 0.364 . . . . 0.0 111.022 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -64.91 -35.08 79.99 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.656 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.77 -45.35 68.23 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.083 177.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.9 mt -54.59 -55.72 26.47 Favored 'General case' 0 C--O 1.201 -1.477 0 O-C-N 124.133 0.895 . . . . 0.0 110.723 177.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.25 -31.69 77.96 Favored Glycine 0 CA--C 1.522 0.508 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.486 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.3 m -70.95 -48.77 51.62 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 117.285 0.542 . . . . 0.0 110.686 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.4 m -68.39 -35.11 69.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.637 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.238 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.422 ' HB3' ' HB3' ' A' ' 41' ' ' GLN . 64.5 mtt -65.82 -33.03 74.92 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.149 177.133 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -62.67 -41.94 99.35 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -68.23 -20.43 64.82 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.706 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.457 ' C ' ' HD2' ' B' ' 91' ' ' LYS . 4.3 mm? -101.0 13.85 33.87 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.048 0.452 . . . . 0.0 112.152 177.181 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.97 26.98 61.15 Favored Glycine 0 C--O 1.241 0.575 0 N-CA-C 114.564 0.586 . . . . 0.0 114.564 173.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.422 ' HB3' ' HB3' ' A' ' 36' ' ' MET . 61.4 tt0 -127.07 124.41 39.19 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -179.246 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -119.27 78.01 18.22 Favored Pre-proline 0 C--N 1.298 -1.639 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.475 ' HG2' HD21 ' A' ' 48' ' ' LEU . 38.9 Cg_endo -89.31 160.09 5.59 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 122.29 1.993 . . . . 0.0 112.1 -179.68 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 39.6 p -80.85 159.98 24.9 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.68 -26.59 68.45 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 120.687 0.28 . . . . 0.0 110.656 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.68 -46.92 85.95 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.105 0.479 . . . . 0.0 110.037 175.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -66.6 -35.02 79.18 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.331 178.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.475 HD21 ' HG2' ' A' ' 43' ' ' PRO . 97.1 mt -66.01 -49.87 66.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.983 177.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -58.43 -43.68 88.81 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 122.959 0.503 . . . . 0.0 110.789 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -65.32 -40.77 94.14 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.083 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.8 tpt -62.27 -42.34 99.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.426 0.631 . . . . 0.0 109.582 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 48' ' ' LEU . 79.5 mt -62.21 -48.98 85.88 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.922 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.913 177.054 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -52.5 -37.09 56.63 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -174.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -66.43 -28.33 68.52 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.09 -1.044 . . . . 0.0 111.637 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.587 HG11 ' HB2' ' A' ' 71' ' ' MET . 7.8 m -101.58 -20.84 5.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.565 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.407 ' HB2' HG22 ' A' ' 52' ' ' ILE . 31.8 t0 -72.59 111.81 8.09 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 123.904 0.882 . . . . 0.0 111.182 -174.582 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.87 -16.05 37.22 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.604 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -98.19 -12.42 21.71 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 -177.009 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.11 31.91 62.42 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -173.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.3 p-10 -98.31 -5.42 32.97 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -172.015 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.58 23.55 39.2 Favored Glycine 0 N--CA 1.44 -1.05 0 C-N-CA 120.087 -1.054 . . . . 0.0 112.458 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.24 139.95 30.46 Favored 'General case' 0 C--O 1.253 1.279 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 178.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 65.2 mt -92.66 111.75 24.95 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -85.41 166.11 16.66 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.438 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 70.7 t80 -56.17 -53.63 61.47 Favored Pre-proline 0 CA--C 1.554 1.127 0 O-C-N 123.425 0.453 . . . . 0.0 112.114 179.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -51.94 -37.35 66.99 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.927 2.418 . . . . 0.0 112.383 175.463 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -74.55 -33.55 62.75 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.458 0.647 . . . . 0.0 110.3 -177.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -68.21 -36.8 80.1 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 87.3 mt -61.73 -47.04 87.05 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.396 175.513 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.8 m -56.24 -47.02 79.33 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 123.764 0.665 . . . . 0.0 110.827 177.178 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.587 ' HB2' HG11 ' A' ' 55' ' ' VAL . 28.3 ttp -57.58 -42.25 82.76 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 123.205 0.602 . . . . 0.0 111.551 179.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 25.1 mmt -75.28 -44.92 43.11 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.434 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.26 77.48 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.927 0.394 . . . . 0.0 110.227 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -63.87 -46.49 84.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.582 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -62.24 -51.74 66.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.394 -175.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.0 ttm . . . . . 0 C--N 1.31 -1.13 0 C-N-CA 125.169 1.388 . . . . 0.0 112.528 -177.892 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 . . . . . 0 C--O 1.209 -1.063 0 N-CA-C 110.937 -0.023 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -70.25 -56.39 6.89 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 116.891 -0.14 . . . . 0.0 111.053 -172.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -63.61 -28.75 70.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.806 0.813 . . . . 0.0 109.878 178.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.5 mm -70.96 -52.74 25.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-N 114.464 -1.243 . . . . 0.0 109.646 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 35.4 ttm180 -71.31 -35.83 71.39 Favored 'General case' 0 C--O 1.204 -1.304 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.13 -176.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -58.26 -37.59 75.24 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 123.257 0.348 . . . . 0.0 111.502 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -70.25 -39.23 75.15 Favored 'General case' 0 C--O 1.211 -0.923 0 O-C-N 123.484 0.49 . . . . 0.0 110.849 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -71.52 -45.39 62.52 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.457 0.646 . . . . 0.0 109.899 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -64.3 -28.3 69.62 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 125.824 1.65 . . . . 0.0 111.974 -176.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 88' ' ' ALA . 8.4 p -77.81 -22.61 13.9 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.877 -179.155 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -89.3 -56.81 3.12 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 174.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 97' ' ' ASN . 16.2 t0 -91.4 80.95 5.45 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 122.136 0.97 . . . . 0.0 109.159 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.614 ' HD2' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -78.53 -30.17 46.88 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.51 -1.223 . . . . 0.0 113.572 -175.688 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.8 -13.49 59.38 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.516 0.674 . . . . 0.0 110.612 -178.544 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.62 76.16 0.8 Allowed Glycine 0 N--CA 1.438 -1.202 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.01 177.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.402 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 35.5 m-80 -110.72 -19.25 12.92 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.199 0.523 . . . . 0.0 109.854 178.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.62 0.98 87.78 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.91 176.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -141.31 145.44 35.48 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -178.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.48 ' HB ' HG13 ' A' ' 136' ' ' VAL . 1.8 mt -105.5 113.54 42.68 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 174.235 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.6 m -96.46 156.58 16.28 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.88 -39.95 96.04 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 117.748 0.249 . . . . 0.0 111.04 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.51 -44.44 96.01 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 123.399 0.437 . . . . 0.0 110.569 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -65.39 -49.74 68.15 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.277 177.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.462 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.3 tm? -60.79 -40.57 93.14 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 115.305 -0.862 . . . . 0.0 108.746 -174.145 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.451 ' HB2' HG21 ' A' ' 121' ' ' VAL . 0.7 OUTLIER -59.47 -47.14 86.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 176.25 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -55.49 -52.73 62.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.725 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.708 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.8 p -66.2 -37.63 80.16 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.553 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.358 -177.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.9 mmt -60.69 -41.32 94.94 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.482 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.7 m -58.82 -41.31 86.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 175.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -74.49 -24.02 58.95 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.443 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.708 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 84.1 mt -87.61 -19.62 27.53 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.097 0.475 . . . . 0.0 110.098 -178.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 83.19 35.05 19.09 Favored Glycine 0 N--CA 1.43 -1.745 0 C-N-CA 120.892 -0.671 . . . . 0.0 111.543 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -98.83 132.95 43.79 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -84.5 46.22 1.21 Allowed 'General case' 0 C--N 1.292 -1.935 0 C-N-CA 123.473 0.709 . . . . 0.0 110.951 -176.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.419 HD12 ' HG3' ' A' ' 109' ' ' MET . 38.2 mt -86.2 129.52 34.82 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.7 p -79.01 168.44 19.68 Favored 'General case' 0 C--N 1.297 -1.704 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.479 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.51 -50.73 71.54 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -176.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.413 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 1.4 mp0 -60.38 -32.87 71.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.486 0.66 . . . . 0.0 109.719 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -71.52 -43.42 66.49 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.873 -178.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.5 m -68.98 -32.55 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 177.198 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -67.23 -45.57 76.35 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.529 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -72.06 -32.59 67.22 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.687 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.5 tpp -53.28 -49.22 67.4 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 172.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.0 mm -67.15 -48.33 79.01 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.208 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.531 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -57.67 -33.75 68.67 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.702 0.801 . . . . 0.0 112.259 -175.025 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -82.76 -23.82 33.78 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.163 0.506 . . . . 0.0 111.189 -178.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -87.98 -24.05 23.65 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.668 0.746 . . . . 0.0 109.522 177.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.482 ' OD2' ' HA2' ' A' ' 132' ' ' GLY . 5.0 t70 -69.96 99.72 1.47 Allowed 'General case' 0 C--N 1.309 -1.152 0 C-N-CA 125.825 1.65 . . . . 0.0 109.763 175.841 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.6 mt -82.33 -47.76 18.73 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -73.84 -10.68 59.91 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 121.203 0.525 . . . . 0.0 110.997 -176.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.482 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 72.56 52.21 10.6 Favored Glycine 0 N--CA 1.437 -1.286 0 N-CA-C 110.282 -1.127 . . . . 0.0 110.282 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -106.46 -17.37 14.29 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -177.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.64 -9.37 52.3 Favored Glycine 0 N--CA 1.437 -1.251 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.245 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -133.3 137.3 45.92 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 -178.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.48 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.3 p -88.14 116.92 30.87 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 CA-C-O 121.589 0.709 . . . . 0.0 110.469 177.063 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -84.5 159.58 20.7 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 114.832 -1.077 . . . . 0.0 109.819 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.494 ' O ' HG13 ' A' ' 142' ' ' VAL . 77.0 t80 -54.85 -46.74 74.71 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 123.858 0.863 . . . . 0.0 111.328 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.2 -22.34 65.84 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -87.77 -43.3 11.97 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.57 -35.47 81.09 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.941 -178.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 138' ' ' TYR . 32.6 m -58.38 -35.89 56.07 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.924 0 CA-C-O 120.933 0.397 . . . . 0.0 110.908 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -75.43 -21.05 58.48 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.41 -178.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 92.4 mmm -76.98 -35.42 57.2 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 90.6 mmm . . . . . 0 N--CA 1.427 -1.619 0 CA-C-N 113.455 -1.702 . . . . 0.0 110.362 177.627 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 82' ' ' LYS . . . . . 0.522 ' O ' ' HG3' ' B' ' 86' ' ' LYS . 87.4 tttt . . . . . 0 C--O 1.225 -0.209 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -59.8 -50.93 71.9 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 176.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.46 -41.81 98.62 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 113.468 -1.696 . . . . 0.0 111.303 177.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.401 ' O ' HG12 ' B' ' 89' ' ' ILE . 74.1 m95 -58.02 -36.43 72.69 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 177.36 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 86' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' B' ' 82' ' ' LYS . 89.1 mttt -52.6 -34.88 52.84 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.483 0.658 . . . . 0.0 110.171 177.087 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -85.02 -54.28 4.75 Favored 'General case' 0 C--O 1.205 -1.283 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.891 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.0 -51.63 51.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.904 0.882 . . . . 0.0 112.748 -176.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.44 HD12 ' HB1' ' A' ' 88' ' ' ALA . 50.4 mm -61.32 -53.35 49.9 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.427 0 CA-C-O 121.543 0.687 . . . . 0.0 109.604 -179.119 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -69.31 -32.43 71.56 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.624 -1.171 . . . . 0.0 112.173 -171.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.457 ' HD2' ' C ' ' A' ' 39' ' ' LEU . 22.3 tptm -67.71 -39.44 84.35 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.373 0.669 . . . . 0.0 109.699 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 92' ' ' ALA . . . . . 0.446 ' HA ' HD22 ' A' ' 112' ' ' LEU . . . -82.42 -51.45 7.83 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.79 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 45.6 tptt . . . . . 0 N--CA 1.443 -0.817 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.953 -177.057 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.409 ' HB3' HD11 ' A' ' 9' ' ' ILE . 13.3 tp . . . . . 0 N--CA 1.423 -1.811 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.7 p -90.64 157.02 17.7 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 122.848 0.459 . . . . 0.0 111.372 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -51.29 -49.84 60.48 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 -174.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -40.67 95.95 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -176.619 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -67.27 -44.05 80.3 Favored 'General case' 0 C--O 1.211 -0.931 0 O-C-N 123.52 0.513 . . . . 0.0 110.015 176.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.519 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 78.5 mt -62.52 -42.4 95.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.614 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.41 -35.76 81.12 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-O 121.555 0.693 . . . . 0.0 110.205 178.232 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -63.27 -49.99 71.92 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.923 178.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.464 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 42.1 m-85 -71.12 -24.0 62.2 Favored 'General case' 0 C--O 1.177 -2.759 0 CA-C-N 114.88 -1.054 . . . . 0.0 112.459 -179.187 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.1 mttt -62.95 -40.92 99.12 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 119.056 0.843 . . . . 0.0 110.023 174.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -58.81 -56.38 22.95 Favored 'General case' 0 C--O 1.25 1.1 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.119 178.075 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.455 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -72.61 -23.76 60.98 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.281 -176.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.464 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 47.5 t80 -64.84 -44.34 90.13 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 177.323 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.8 t -75.76 -16.94 60.06 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.864 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.455 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 38.6 tp -72.18 -41.51 66.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.054 174.536 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -80.41 -40.45 26.41 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.223 178.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -72.44 99.05 2.38 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.464 ' HE2' HG12 ' A' ' 35' ' ' VAL . 56.3 mttm -83.63 1.73 40.89 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -174.205 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.578 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 10.4 m-20 -105.68 -13.9 15.42 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.533 179.349 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.92 34.52 55.77 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.85 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.578 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 2.6 p30 -113.29 -16.88 12.44 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -178.577 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.73 33.6 33.6 Favored Glycine 0 C--N 1.311 -0.809 0 N-CA-C 114.999 0.76 . . . . 0.0 114.999 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.7 p -149.28 129.04 13.27 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 171.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 60.0 mt -99.18 120.19 48.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-O 121.298 0.571 . . . . 0.0 112.074 -170.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.0 p -93.45 175.18 6.85 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.993 178.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 46.2 p -67.58 -25.52 65.82 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.493 0.664 . . . . 0.0 109.734 176.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -57.89 -57.05 14.48 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.014 175.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -65.11 -40.73 94.94 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.373 -177.596 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.7 -52.55 64.99 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 123.488 0.492 . . . . 0.0 110.547 175.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.79 -31.05 78.59 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.312 -0.947 . . . . 0.0 112.798 -178.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.0 m -72.74 -43.22 63.19 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 117.467 0.634 . . . . 0.0 111.226 178.34 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.616 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 35.0 m -67.43 -36.06 75.31 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.422 176.766 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.47 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 66.2 mtt -67.48 -35.09 78.49 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.187 177.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -61.1 -38.72 87.28 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.3 t -72.02 -28.3 63.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.809 177.19 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 80.4 mt -78.91 -20.15 50.09 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.881 0.372 . . . . 0.0 110.505 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.37 32.46 7.36 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 121.373 -0.442 . . . . 0.0 112.27 179.049 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -145.18 139.53 27.3 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 -126.25 80.03 69.21 Favored Pre-proline 0 C--N 1.3 -1.573 0 O-C-N 121.773 -0.579 . . . . 0.0 112.403 -179.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.47 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 21.9 Cg_exo -69.82 149.43 66.53 Favored 'Trans proline' 0 C--O 1.242 0.705 0 C-N-CA 121.82 1.68 . . . . 0.0 109.447 173.066 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.1 p -78.95 162.53 25.92 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -174.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -44.49 -56.44 4.29 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 126.162 1.785 . . . . 0.0 113.657 -174.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.95 -34.52 76.74 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -175.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -60.78 -45.47 94.23 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.434 ' O ' HG13 ' A' ' 52' ' ' ILE . 96.7 mt -60.83 -43.19 98.59 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.991 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -73.55 -31.78 63.84 Favored 'General case' 0 N--CA 1.44 -0.927 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.448 -178.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.501 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 31.2 t70 -67.27 -40.06 86.12 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 119.719 -0.792 . . . . 0.0 109.577 175.571 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.8 tpt -59.37 -37.2 77.3 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.368 175.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 48' ' ' LEU . 45.5 mt -66.41 -50.93 63.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.725 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.772 174.37 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -59.81 -23.12 63.07 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 124.016 0.926 . . . . 0.0 112.724 -173.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 17.0 mm-40 -62.0 -36.94 83.02 Favored 'General case' 0 N--CA 1.396 -3.143 0 C-N-CA 124.479 1.112 . . . . 0.0 111.164 175.675 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.544 HG11 ' SD ' ' A' ' 71' ' ' MET . 28.9 m -109.02 -14.41 10.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.761 0.315 . . . . 0.0 111.383 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -72.61 114.14 10.42 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.72 -18.91 30.02 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.964 -177.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -97.12 -12.37 23.21 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.57 37.06 88.03 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 -174.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.0 p-10 -101.49 -7.65 22.65 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.36 18.37 28.75 Favored Glycine 0 N--CA 1.436 -1.324 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.937 173.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 p -143.64 142.48 31.04 Favored 'General case' 0 C--O 1.253 1.276 0 CA-C-N 116.731 0.265 . . . . 0.0 110.436 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.9 mt -92.19 108.89 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.64 169.7 15.96 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.437 ' CE2' HD11 ' A' ' 69' ' ' LEU . 52.6 t80 -58.59 -55.88 41.32 Favored Pre-proline 0 CA--C 1.554 1.11 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -176.149 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.01 -37.08 78.3 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.498 2.132 . . . . 0.0 112.117 176.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -70.25 -39.84 74.79 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.009 0.433 . . . . 0.0 110.433 -178.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -66.08 -39.85 90.36 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.437 HD11 ' CE2' ' A' ' 65' ' ' PHE . 83.4 mt -65.35 -45.24 84.95 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.354 177.558 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 89.1 m -56.96 -44.71 82.87 Favored 'General case' 0 C--O 1.239 0.535 0 O-C-N 123.466 0.479 . . . . 0.0 109.976 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.544 ' SD ' HG11 ' A' ' 55' ' ' VAL . 32.5 ttp -58.9 -49.13 78.95 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.879 177.653 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.5 mmt -62.52 -43.84 97.84 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.73 -24.69 66.97 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.087 0.47 . . . . 0.0 111.476 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.9 mtp180 -82.77 -41.54 19.05 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.386 0.613 . . . . 0.0 109.497 175.148 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -67.99 -28.71 67.67 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.705 -1.134 . . . . 0.0 111.623 -172.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 73.8 mtm . . . . . 0 C--N 1.304 -1.391 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.138 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 121.526 0.679 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.55 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 1.6 mp0 -70.23 -33.25 71.43 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.717 178.785 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -64.02 -46.66 83.51 Favored 'General case' 0 CA--C 1.492 -1.266 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.9 mm -64.73 -35.77 75.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 114.759 -1.11 . . . . 0.0 109.311 -176.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -64.14 -49.76 70.89 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.444 175.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' A' ' 83' ' ' GLU . 40.4 mm-40 -64.41 -36.15 83.22 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.849 0.356 . . . . 0.0 111.83 -176.713 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.2 -28.06 67.77 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.583 177.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -80.51 -49.55 11.22 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.594 0.712 . . . . 0.0 109.097 176.051 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -53.94 -30.91 48.58 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 126.379 1.872 . . . . 0.0 112.681 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.441 HG21 ' O ' ' B' ' 92' ' ' ALA . 14.2 p -70.8 -29.39 37.51 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.641 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -86.24 -49.47 7.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 176.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -88.44 79.33 7.7 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.975 179.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HE2' ' O ' ' A' ' 91' ' ' VAL . 70.7 mmtt -75.53 -30.55 59.81 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.621 -177.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -85.37 -12.48 52.07 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -177.083 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.81 51.6 6.29 Favored Glycine 0 CA--C 1.502 -0.733 0 C-N-CA 120.77 -0.729 . . . . 0.0 111.678 177.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -90.31 -17.96 26.43 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 123.073 0.549 . . . . 0.0 110.053 -179.423 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.15 9.56 79.89 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.456 178.519 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 39.7 p90 -157.28 156.96 33.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.532 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.0 mt -105.21 134.88 45.44 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.0 t -107.59 151.01 26.19 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 177.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.12 -55.87 29.5 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -175.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.0 -26.94 68.5 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.137 0.494 . . . . 0.0 110.965 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.95 -40.49 65.35 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.515 177.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.492 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.4 tt -63.56 -39.43 94.38 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.628 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.453 ' O ' ' HD2' ' A' ' 106' ' ' ARG . 4.2 tmm_? -66.76 -38.49 86.7 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -59.73 -48.75 80.45 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.048 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.609 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.8 p -65.02 -33.42 63.62 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.298 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.099 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.519 ' HG3' HD12 ' A' ' 116' ' ' LEU . 21.7 mmt -59.72 -45.51 91.96 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-O 120.751 0.31 . . . . 0.0 111.569 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 23.7 m -64.69 -29.75 70.75 Favored 'General case' 0 CA--C 1.563 1.459 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.214 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.73 -24.35 41.68 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.105 0.479 . . . . 0.0 111.091 177.139 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 77.3 mt -89.17 -19.95 24.84 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.722 0.409 . . . . 0.0 111.01 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.27 24.97 9.79 Favored Glycine 0 C--N 1.308 -1.014 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.905 -178.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -111.1 154.44 24.27 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 121.412 0.625 . . . . 0.0 109.5 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -124.09 104.68 9.01 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.207 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.519 HD12 ' HG3' ' A' ' 109' ' ' MET . 61.7 mt -124.52 151.75 44.27 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.839 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 35.7 p -86.85 169.63 12.38 Favored 'General case' 0 C--N 1.29 -2.012 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.415 ' HA ' HG22 ' A' ' 121' ' ' VAL . 2.2 m-20 -66.18 -35.13 79.66 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.17 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.96 -43.69 94.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.047 175.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -65.57 -53.65 38.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.885 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.454 ' O ' HG12 ' A' ' 125' ' ' ILE . 23.1 m -65.36 -36.47 77.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.566 -176.279 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -69.08 -34.3 74.91 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 120.893 0.378 . . . . 0.0 110.441 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.41 -40.51 77.25 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.246 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.4 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 56.2 mtt -56.62 -50.99 70.37 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.701 176.724 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.2 mm -58.02 -45.52 88.07 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 O-C-N 123.919 0.762 . . . . 0.0 109.484 178.137 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.6 ttp-105 -58.92 -31.74 68.93 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -176.119 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' A' ' 128' ' ' ALA . 0.4 OUTLIER -79.4 -32.82 43.07 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 117.974 -1.49 . . . . 0.0 109.931 178.357 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.433 ' N ' ' HG3' ' A' ' 127' ' ' GLU . . . -84.75 -24.76 28.67 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.582 -175.223 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -73.51 89.53 1.69 Allowed 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 124.117 0.967 . . . . 0.0 108.584 175.361 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 84.7 mt -82.84 -35.85 12.69 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.926 -174.284 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -81.31 -9.29 59.78 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.561 0.696 . . . . 0.0 111.296 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.08 49.57 15.82 Favored Glycine 0 CA--C 1.499 -0.908 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.697 175.159 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -115.47 -16.46 11.38 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-O 121.385 0.612 . . . . 0.0 110.942 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.0 5.35 60.97 Favored Glycine 0 C--N 1.304 -1.205 0 N-CA-C 111.097 -0.801 . . . . 0.0 111.097 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -131.73 125.21 31.43 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.532 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.2 p -94.58 111.28 25.14 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.833 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.357 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -85.85 168.98 13.75 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.431 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.576 ' O ' HG13 ' A' ' 142' ' ' VAL . 92.5 t80 -57.18 -45.77 83.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.103 -176.491 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.471 ' O ' HG22 ' A' ' 142' ' ' VAL . 10.8 pt-20 -61.91 -27.95 69.18 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.31 0.576 . . . . 0.0 111.678 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HG3' ' HG3' ' A' ' 139' ' ' GLU . 38.4 mt-10 -82.39 -41.02 20.47 Favored 'General case' 0 N--CA 1.414 -2.259 0 CA-C-O 122.126 0.965 . . . . 0.0 108.458 -177.614 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -60.12 -44.65 94.72 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.74 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.576 HG13 ' O ' ' A' ' 138' ' ' TYR . 19.7 m -56.33 -33.85 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 CA-C-O 121.126 0.489 . . . . 0.0 112.193 -177.353 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -80.09 -50.9 9.68 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.521 -174.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -24.09 63.09 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.408 -176.23 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.446 -0.627 0 C-N-CA 120.646 -0.422 . . . . 0.0 112.004 178.903 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 86.2 tttt . . . . . 0 C--O 1.246 0.882 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -71.41 -22.65 61.83 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.11 177.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.57 -44.45 90.67 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.4 ' CZ2' ' HB3' ' A' ' 124' ' ' MET . 52.7 m95 -71.06 -36.06 72.16 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.092 175.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -57.19 -54.08 50.84 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 178.187 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -59.4 -46.14 89.53 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.573 -1.649 . . . . 0.0 111.104 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.2 -55.84 29.77 Favored 'General case' 0 CA--C 1.503 -0.837 0 O-C-N 123.283 0.364 . . . . 0.0 111.122 -179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.401 ' O ' ' HB2' ' B' ' 93' ' ' LYS . 50.5 mm -60.04 -47.3 92.37 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.711 0 O-C-N 123.524 0.515 . . . . 0.0 110.227 -178.261 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -54.77 -51.98 64.0 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 123.239 0.616 . . . . 0.0 112.141 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.437 ' HA ' HD22 ' A' ' 39' ' ' LEU . 19.8 tptm -69.84 -35.89 75.11 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.097 0.475 . . . . 0.0 111.572 -178.305 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 92' ' ' ALA . . . . . 0.441 ' O ' HG21 ' A' ' 91' ' ' VAL . . . -77.82 -34.16 52.13 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.237 -177.872 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 8.1 tmtm? . . . . . 0 N--CA 1.475 0.798 0 C-N-CA 124.535 1.134 . . . . 0.0 109.362 -178.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.553 ' HG ' ' HB2' ' A' ' 8' ' ' GLN . 9.1 tp . . . . . 0 N--CA 1.426 -1.635 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.454 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 71.4 p -84.44 159.2 20.83 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 119.519 -0.872 . . . . 0.0 109.591 177.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.61 -30.76 71.59 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 111.946 0.351 . . . . 0.0 111.946 -175.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.449 ' CD ' ' H ' ' A' ' 7' ' ' GLU . 1.3 mp0 -57.54 -46.11 84.28 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 177.191 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.553 ' HB2' ' HG ' ' A' ' 4' ' ' LEU . 60.3 mm-40 -65.75 -51.72 56.92 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.408 -179.325 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.443 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 78.8 mt -57.83 -36.99 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.73 -176.31 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' ' 13' ' ' LYS . . . -67.26 -40.84 86.26 Favored 'General case' 0 C--O 1.254 1.29 0 CA-C-O 121.594 0.711 . . . . 0.0 110.6 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -64.64 -40.81 96.1 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.375 -0.83 . . . . 0.0 108.995 176.077 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.406 ' CE2' HD21 ' A' ' 4' ' ' LEU . 36.4 m-85 -60.8 -38.16 84.42 Favored 'General case' 0 C--O 1.162 -3.516 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.307 174.62 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 10' ' ' ALA . 32.8 mmtp -52.46 -56.47 14.85 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-N 118.318 0.508 . . . . 0.0 111.155 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -64.85 -51.27 62.99 Favored 'General case' 0 C--O 1.25 1.113 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.18 -37.55 87.87 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.996 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -59.8 -42.63 93.85 Favored 'General case' 0 C--O 1.206 -1.205 0 C-N-CA 123.489 0.716 . . . . 0.0 110.272 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.8 m -68.32 -23.69 64.75 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 123.516 0.51 . . . . 0.0 110.742 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.7 tt -73.27 -31.25 63.96 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 121.365 0.602 . . . . 0.0 109.441 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -87.71 -33.04 18.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.475 179.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -79.52 90.61 5.1 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -64.47 -47.06 80.39 Favored 'General case' 0 N--CA 1.428 -1.546 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 -170.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.429 ' OD2' ' HB3' ' A' ' 24' ' ' ASP . 6.7 p-10 -83.2 -13.23 55.84 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.161 -178.112 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.64 58.5 6.35 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 116.008 -0.542 . . . . 0.0 113.145 177.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.429 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 4.8 p-10 -113.62 -15.91 12.43 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 120.991 0.424 . . . . 0.0 110.064 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.33 10.49 38.76 Favored Glycine 0 N--CA 1.43 -1.732 0 CA-C-N 115.962 -0.563 . . . . 0.0 113.955 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 71.2 p -136.75 160.53 38.58 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 118.02 0.91 . . . . 0.0 108.987 175.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.0 mt -120.96 120.4 62.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.152 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.6 p -95.13 175.41 6.63 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.616 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -59.2 -42.75 91.66 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 123.605 0.762 . . . . 0.0 110.606 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -58.73 -44.76 90.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.888 178.609 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -67.48 -38.69 84.76 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.772 -179.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.23 -46.71 89.27 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.146 176.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.4 -25.19 75.71 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.443 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.9 m -66.71 -54.55 21.77 Favored 'General case' 0 C--O 1.251 1.162 0 CA-C-O 121.31 0.576 . . . . 0.0 109.633 176.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 28.2 m -67.34 -36.13 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.145 -178.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.411 ' HB3' ' O ' ' A' ' 41' ' ' GLN . 49.7 mtt -66.48 -44.4 82.79 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 177.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -59.46 -36.38 75.86 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.0 t -67.62 -14.0 62.56 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.005 179.128 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 59.6 mt -103.2 -11.57 17.92 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.327 177.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.09 -7.07 32.7 Favored Glycine 0 C--N 1.311 -0.851 0 C-N-CA 120.091 -1.052 . . . . 0.0 114.122 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.411 ' O ' ' HB3' ' A' ' 36' ' ' MET . 0.0 OUTLIER -107.56 131.3 54.5 Favored 'General case' 0 CA--C 1.483 -1.633 0 CA-C-N 118.013 0.907 . . . . 0.0 110.724 177.739 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.34 3.5 p30 -135.0 71.69 68.9 Favored Pre-proline 0 C--N 1.284 -2.28 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 173.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.87 157.19 25.11 Favored 'Trans proline' 0 C--N 1.357 1.016 0 C-N-CA 123.276 2.651 . . . . 0.0 111.472 173.09 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.5 p -78.17 165.18 24.26 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.425 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.84 -40.83 70.02 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 123.541 0.736 . . . . 0.0 112.04 -179.036 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.68 -43.75 93.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.188 0.518 . . . . 0.0 110.958 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -64.16 -42.66 96.65 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.544 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 87.7 mt -70.41 -38.59 74.64 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.306 -179.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -64.26 -40.49 96.09 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 123.151 0.58 . . . . 0.0 109.603 177.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.59 -35.56 78.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.76 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.507 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 66.5 mmm -74.38 -33.62 63.1 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.822 177.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.5 mt -66.97 -40.81 86.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 121.371 0.605 . . . . 0.0 109.481 175.434 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.423 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.9 t30 -63.66 -12.46 34.09 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.254 -178.558 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.507 ' HB2' ' O ' ' A' ' 51' ' ' MET . 12.2 mm-40 -67.21 -23.54 65.75 Favored 'General case' 0 N--CA 1.394 -3.268 0 C-N-CA 123.742 0.817 . . . . 0.0 111.354 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.541 ' CG1' ' HB2' ' A' ' 71' ' ' MET . 17.4 m -119.58 -19.94 5.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.973 174.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.423 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 11.3 t70 -78.46 82.28 4.74 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.771 0.796 . . . . 0.0 111.843 -173.733 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.92 -21.81 26.06 Favored 'General case' 0 C--N 1.299 -1.621 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.434 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -81.78 -11.97 58.76 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.34 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.77 12.54 84.42 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 115.41 0.924 . . . . 0.0 115.41 173.322 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -80.48 -14.29 58.39 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.962 1.381 . . . . 0.0 110.395 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 79.75 20.34 68.62 Favored Glycine 0 N--CA 1.437 -1.279 0 CA-C-N 115.843 -0.617 . . . . 0.0 113.432 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.97 148.19 39.95 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.076 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.2 mt -92.26 116.17 32.82 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 108.758 -0.831 . . . . 0.0 108.758 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.44 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 7.1 t70 -87.14 172.53 9.87 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 174.407 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.444 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 46.7 t80 -57.13 -51.65 80.07 Favored Pre-proline 0 CA--C 1.555 1.168 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -175.415 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.44 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 8.7 Cg_endo -51.58 -42.48 55.81 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 122.973 2.448 . . . . 0.0 112.6 175.387 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.85 -39.63 87.66 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.632 0.729 . . . . 0.0 110.067 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -66.38 -40.66 89.84 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.598 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 78.0 mt -63.73 -37.78 88.66 Favored 'General case' 0 C--O 1.206 -1.196 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.987 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.438 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 86.5 m -59.22 -50.88 72.32 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 123.493 0.496 . . . . 0.0 110.912 178.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.541 ' HB2' ' CG1' ' A' ' 55' ' ' VAL . 34.0 ttp -66.03 -36.65 83.82 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.053 0.454 . . . . 0.0 111.84 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.5 mmt -82.22 -24.87 34.64 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.786 -0.766 . . . . 0.0 112.334 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.71 -29.89 67.39 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 173.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 70' ' ' THR . 99.8 mtt180 -66.24 -29.86 70.19 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.731 0.777 . . . . 0.0 109.529 174.034 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -81.94 -12.14 58.53 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.937 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.9 ttm . . . . . 0 C--N 1.313 -1.007 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.484 -179.195 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.44 -0.94 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.601 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 44.0 mt-10 -62.84 -58.47 7.29 Favored 'General case' 0 CA--C 1.489 -1.377 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.943 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -49.6 -45.36 47.94 Favored 'General case' 0 C--O 1.251 1.156 0 C-N-CA 124.817 1.247 . . . . 0.0 110.376 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.531 HG21 HG12 ' A' ' 142' ' ' VAL . 40.0 mm -66.75 -50.73 63.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 114.416 -1.265 . . . . 0.0 110.426 -177.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -70.66 -27.68 64.22 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.138 -177.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.601 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 51.4 mt-10 -60.08 -44.9 94.44 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 175.23 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.34 -38.11 81.17 Favored 'General case' 0 C--O 1.21 -1.008 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.831 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.76 -43.6 83.62 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.404 0.621 . . . . 0.0 110.139 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 -66.23 -26.76 67.52 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 124.739 1.216 . . . . 0.0 111.7 -176.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.0 p -83.76 -19.76 9.39 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 C-N-CA 120.308 -0.557 . . . . 0.0 111.287 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -91.3 -49.78 6.17 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 122.037 -0.414 . . . . 0.0 110.012 177.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -84.42 107.38 16.65 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 177.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -73.28 -26.62 61.16 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.342 -172.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -103.81 -14.18 16.14 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.529 0.68 . . . . 0.0 110.789 -176.13 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.04 45.15 58.14 Favored Glycine 0 N--CA 1.43 -1.725 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -176.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -85.61 -17.83 35.03 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 121.427 0.632 . . . . 0.0 109.644 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 101.45 16.08 25.7 Favored Glycine 0 N--CA 1.434 -1.449 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.515 173.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -146.71 131.39 17.88 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -177.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.475 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.1 mt -100.68 126.93 54.24 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.598 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.5 t -107.24 144.72 33.63 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.46 94.21 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.208 0.603 . . . . 0.0 111.782 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.56 89.09 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.093 0.473 . . . . 0.0 110.802 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.531 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 5.0 tp10 -72.15 -45.36 60.8 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.498 178.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.506 ' O ' ' HG2' ' A' ' 109' ' ' MET . 8.5 tt -60.23 -37.81 81.49 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 -176.131 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.487 ' HB2' HG21 ' A' ' 121' ' ' VAL . 45.8 ttt180 -63.14 -37.15 86.06 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.727 177.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' HIS . . . . . 0.531 ' HB2' ' O ' ' A' ' 104' ' ' GLU . 56.7 m170 -51.98 -53.51 40.66 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.365 177.699 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.58 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.3 p -71.02 -30.61 42.01 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.621 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.335 -176.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.506 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.2 mmt -63.6 -47.02 83.16 Favored 'General case' 0 CA--C 1.494 -1.209 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.7 m -62.11 -32.75 73.35 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.406 177.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -73.48 -33.57 64.89 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.216 177.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 84.9 mt -84.65 -20.87 30.62 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.009 0.433 . . . . 0.0 110.986 -176.302 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 89.48 18.12 53.23 Favored Glycine 0 N--CA 1.431 -1.685 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.1 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -84.58 107.57 16.87 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 176.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -70.3 99.63 1.58 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.4 -177.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 62.9 mt -137.1 149.04 47.09 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -89.86 173.83 8.03 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -66.94 -34.17 77.19 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -61.28 -47.41 86.13 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.519 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -62.68 -48.76 77.91 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.459 -177.26 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.487 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.2 m -66.96 -33.42 63.27 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 CA-C-O 121.014 0.435 . . . . 0.0 110.9 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -74.35 -37.12 63.59 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.0 0.429 . . . . 0.0 109.971 178.559 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -61.44 -41.6 97.45 Favored 'General case' 0 C--O 1.248 1.025 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.427 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 62.3 mtt -53.71 -56.83 13.9 Favored 'General case' 0 CA--C 1.504 -0.804 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.752 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.9 mm -57.9 -50.57 77.38 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.724 0 CA-C-N 114.482 -1.236 . . . . 0.0 111.451 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -61.43 -21.67 64.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -83.81 -36.91 23.16 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.795 176.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.86 -31.04 40.41 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 120.904 0.383 . . . . 0.0 110.525 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.38 94.65 0.96 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.208 1.403 . . . . 0.0 109.532 175.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.67 -38.89 15.39 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.921 -176.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -74.76 -10.71 59.77 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.777 -176.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.72 45.63 27.38 Favored Glycine 0 N--CA 1.441 -0.984 0 C-N-CA 120.664 -0.779 . . . . 0.0 111.538 178.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -105.37 -15.94 14.89 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.858 0.837 . . . . 0.0 109.664 -176.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.03 5.04 73.98 Favored Glycine 0 CA--C 1.495 -1.176 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -143.71 125.53 15.16 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.475 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.4 OUTLIER -89.21 128.18 41.44 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.274 0 O-C-N 123.556 0.535 . . . . 0.0 110.131 -179.473 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -91.12 170.97 9.58 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.977 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.624 ' O ' HG13 ' A' ' 142' ' ' VAL . 81.6 t80 -54.34 -44.79 72.41 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -175.558 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -68.58 -25.53 64.93 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HB2' HG23 ' A' ' 136' ' ' VAL . 51.7 mt-10 -81.27 -39.1 25.79 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 176.74 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -67.22 -43.03 83.04 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.699 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.624 HG13 ' O ' ' A' ' 138' ' ' TYR . 27.1 m -53.78 -36.52 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.695 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 48.1 tp60 -68.83 -42.21 77.5 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.765 -177.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 27.9 ttt -86.5 -30.24 22.13 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.41 -178.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.412 ' SD ' HG21 ' B' ' 89' ' ' ILE . 14.5 tpt . . . . . 0 C--N 1.308 -1.196 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.313 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp . . . . . 0 N--CA 1.449 -0.513 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 83' ' ' GLU . . . . . 0.436 ' O ' ' HB3' ' B' ' 86' ' ' LYS . 37.1 mt-10 -81.63 -27.43 34.14 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.189 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.8 -50.88 54.51 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.556 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.528 ' O ' HG12 ' B' ' 89' ' ' ILE . 84.5 m95 -63.66 -32.19 73.6 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.487 176.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 86' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' B' ' 83' ' ' GLU . 37.8 ttpt -54.09 -58.45 7.27 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 175.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -57.35 -45.54 84.24 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 114.28 -1.327 . . . . 0.0 111.78 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.93 -61.5 2.34 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 124.402 1.064 . . . . 0.0 112.501 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.528 HG12 ' O ' ' B' ' 85' ' ' TRP . 36.7 pt -65.14 -36.26 77.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -174.46 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -64.33 -55.93 17.91 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.414 ' CG ' ' HB3' ' A' ' 112' ' ' LEU . 3.4 tppp? -68.32 -31.54 71.03 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.645 -174.444 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.88 -37.34 73.03 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.873 178.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 64.1 tttp . . . . . 0 CA--C 1.55 0.95 0 CA-C-O 121.876 0.846 . . . . 0.0 109.961 177.645 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.7 tp . . . . . 0 N--CA 1.414 -2.238 0 N-CA-C 103.891 -2.633 . . . . 0.0 103.891 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.2 p -68.18 148.02 51.45 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.602 -0.839 . . . . 0.0 109.254 -177.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -61.94 -25.66 67.73 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.0 0.429 . . . . 0.0 110.591 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -64.94 -51.23 62.99 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.034 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -65.52 -35.17 80.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.788 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.532 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 51.5 mt -67.57 -32.31 56.41 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.269 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.125 177.503 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.59 -40.53 88.94 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 175.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.45 -43.07 97.22 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.063 175.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -73.61 -15.41 61.27 Favored 'General case' 0 C--O 1.169 -3.179 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 68.6 mttm -72.97 -42.99 62.78 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 119.251 0.932 . . . . 0.0 108.636 175.2 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -62.36 -50.07 73.03 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.51 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.64 -40.74 97.62 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.137 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.445 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 92.8 t80 -60.17 -48.63 80.93 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 123.289 0.636 . . . . 0.0 110.094 178.561 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 m -69.3 -17.52 63.74 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 123.426 0.453 . . . . 0.0 111.464 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.88 -34.88 78.75 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 174.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.596 ' CD2' HG21 ' A' ' 35' ' ' VAL . 17.1 m-85 -90.31 -44.98 9.34 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.001 177.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -87.27 83.34 7.39 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -71.55 -15.57 62.29 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -170.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.484 ' OD1' ' HB3' ' A' ' 24' ' ' ASP . 4.3 p-10 -97.37 -9.85 26.65 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 118.885 -1.126 . . . . 0.0 110.007 177.57 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.87 50.58 66.0 Favored Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.403 -0.817 . . . . 0.0 113.373 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.484 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 1.2 p-10 -104.08 -17.3 14.99 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.544 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.54 2.53 50.25 Favored Glycine 0 N--CA 1.436 -1.35 0 C-N-CA 120.022 -1.085 . . . . 0.0 114.513 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 52.9 p -137.31 129.44 29.32 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.606 1.203 . . . . 0.0 109.346 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.1 mt -96.29 122.21 47.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 -174.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -94.84 163.44 13.34 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.039 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 34.1 p -63.55 -30.85 71.91 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.801 0.334 . . . . 0.0 111.5 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -59.93 -46.48 89.25 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.134 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -63.18 -46.87 85.09 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.462 ' HB3' HD22 ' A' ' 48' ' ' LEU . 92.7 mt -54.15 -55.57 26.53 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.21 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.7 -31.56 76.31 Favored Glycine 0 C--N 1.305 -1.165 0 C-N-CA 119.328 -1.415 . . . . 0.0 113.131 -176.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 48.5 m -66.02 -46.73 76.85 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 117.04 0.42 . . . . 0.0 110.569 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.596 HG21 ' CD2' ' A' ' 19' ' ' PHE . 34.1 m -70.02 -37.34 72.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.108 178.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.412 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 1.9 mpp? -64.62 -39.83 94.4 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.528 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.545 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 22.3 ttt180 -66.49 -34.02 76.99 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 121.091 0.472 . . . . 0.0 110.148 178.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.8 m -69.69 -25.68 64.0 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.547 -0.752 . . . . 0.0 109.716 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.6 mt -87.29 -1.62 58.04 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.972 177.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 102.34 -10.0 56.29 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.679 176.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.545 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 60.9 tt0 -95.76 138.85 32.82 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -177.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -117.95 81.68 16.19 Favored Pre-proline 0 C--N 1.301 -1.543 0 O-C-N 121.609 -0.682 . . . . 0.0 109.822 177.446 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -84.85 149.78 11.05 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 122.293 1.995 . . . . 0.0 111.793 178.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.3 p -90.27 170.28 10.4 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.322 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -55.35 -47.36 75.84 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.447 1.099 . . . . 0.0 110.073 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -45.34 84.13 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.776 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 51' ' ' MET . 42.9 mt-10 -65.61 -44.25 87.09 Favored 'General case' 0 C--O 1.221 -0.431 0 O-C-N 123.655 0.597 . . . . 0.0 111.557 -177.218 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.462 HD22 ' HB3' ' A' ' 32' ' ' LEU . 88.9 mt -69.02 -39.27 79.37 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.277 -177.826 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -71.25 -33.74 70.11 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.89 -36.88 84.8 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.413 0.625 . . . . 0.0 109.394 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.497 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 94.8 mmm -67.51 -47.37 70.19 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.222 177.37 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 58.5 mt -59.59 -44.12 92.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.18 0.514 . . . . 0.0 110.444 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.503 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.1 t30 -55.55 -28.52 55.36 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 114.908 1.448 . . . . 0.0 114.908 -173.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 51' ' ' MET . 9.5 pt-20 -69.04 -27.24 65.48 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 119.198 -1.001 . . . . 0.0 112.591 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.513 HG11 ' HB2' ' A' ' 71' ' ' MET . 34.7 m -101.67 -11.81 8.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.579 0.705 . . . . 0.0 109.794 177.097 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.503 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 25.9 t70 -87.92 75.7 8.78 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.423 -173.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.6 -20.57 39.52 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.606 0.717 . . . . 0.0 109.798 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -82.38 -6.96 59.61 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.312 178.087 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 59.54 43.46 97.57 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 115.895 1.118 . . . . 0.0 115.895 172.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -109.64 -1.33 18.17 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 119.252 -0.979 . . . . 0.0 110.721 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 69.34 23.15 76.48 Favored Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.603 -0.726 . . . . 0.0 113.423 176.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -141.29 149.77 41.68 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 52.3 mt -103.87 114.79 44.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.422 ' HB2' ' HD2' ' A' ' 66' ' ' PRO . 1.2 p30 -78.68 163.25 25.6 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 119.724 -0.791 . . . . 0.0 110.261 174.158 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.5 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 31.8 t80 -54.21 -50.5 84.3 Favored Pre-proline 0 C--N 1.313 -1.017 0 O-C-N 123.913 0.758 . . . . 0.0 110.879 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.5 ' HD3' ' HB3' ' A' ' 65' ' ' PHE . 59.5 Cg_exo -47.2 -51.58 9.21 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 122.233 1.955 . . . . 0.0 112.739 171.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.08 -47.13 81.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.324 0.583 . . . . 0.0 110.468 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.445 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 37.4 t80 -61.56 -42.99 99.65 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.31 -177.63 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 90.9 mt -63.61 -44.14 94.83 Favored 'General case' 0 CA--C 1.504 -0.804 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.542 177.662 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.0 m -59.25 -47.72 84.3 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.778 0.674 . . . . 0.0 109.843 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.513 ' HB2' HG11 ' A' ' 55' ' ' VAL . 36.2 ttp -60.96 -41.33 96.13 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.428 179.159 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 21.3 mmt -69.27 -42.45 75.52 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 178.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.31 -39.63 93.63 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.816 0.341 . . . . 0.0 110.303 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -61.77 -39.59 92.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.927 175.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -80.63 -3.52 50.76 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 122.228 1.013 . . . . 0.0 110.445 -175.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 51.5 ttm . . . . . 0 C--N 1.305 -1.331 0 CA-C-O 121.798 0.809 . . . . 0.0 108.885 177.602 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 . . . . . 0 CA--C 1.532 0.263 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.465 ' O ' ' HB2' ' A' ' 87' ' ' GLU . 51.2 mm-40 -52.48 -62.42 1.65 Allowed 'General case' 0 C--O 1.202 -1.409 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -179.54 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -48.16 -45.82 33.92 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.228 1.011 . . . . 0.0 111.464 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.401 ' HA ' ' HG2' ' A' ' 145' ' ' MET . 4.5 mm -69.8 -52.42 31.67 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.012 -171.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.4 ttp180 -75.97 -22.27 56.1 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.278 -177.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 6.4 tp10 -64.6 -52.27 58.4 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 176.05 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.418 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -62.6 -37.91 88.1 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 114.484 -1.235 . . . . 0.0 110.231 179.317 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -65.15 -46.56 80.38 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.457 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -69.73 -27.56 65.06 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.646 0.778 . . . . 0.0 112.752 -175.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.418 HG12 ' O ' ' A' ' 88' ' ' ALA . 13.7 p -72.97 -20.13 18.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 119.464 -0.895 . . . . 0.0 110.438 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -91.5 -60.57 1.85 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 173.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.43 ' CG ' ' H ' ' A' ' 97' ' ' ASN . 14.0 t0 -86.81 82.72 7.73 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 122.689 1.233 . . . . 0.0 109.224 177.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -78.11 -29.64 49.07 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.949 -174.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -85.68 -13.06 49.68 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-O 121.356 0.598 . . . . 0.0 110.329 -174.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.98 63.34 2.31 Favored Glycine 0 N--CA 1.426 -2.013 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 179.438 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.43 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 38.5 m-80 -92.33 -19.17 22.41 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.55 13.68 79.7 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -166.62 153.49 9.07 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 124.316 1.046 . . . . 0.0 109.587 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.457 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.4 mt -110.94 128.3 67.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 19.1 m -103.53 160.36 14.8 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.09 -45.01 94.13 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 122.256 0.222 . . . . 0.0 111.338 -178.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.44 -43.8 88.91 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 123.75 0.656 . . . . 0.0 110.302 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -57.76 -56.58 20.09 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.094 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.441 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.0 tm? -58.68 -44.65 90.28 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.295 -1.321 . . . . 0.0 108.995 -173.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.514 ' HB2' HG21 ' A' ' 121' ' ' VAL . 27.8 ttp180 -61.0 -48.74 80.41 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.905 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -60.16 -39.48 86.55 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.472 -178.153 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.572 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 10.0 p -73.32 -34.3 43.29 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.384 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.488 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.593 ' HG3' HD12 ' A' ' 116' ' ' LEU . 23.1 mmt -63.8 -41.87 97.82 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-N 116.741 -0.209 . . . . 0.0 111.415 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.7 m -62.28 -35.73 79.89 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 176.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -68.81 -33.68 74.25 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.435 0.636 . . . . 0.0 110.381 176.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 52.9 mt -82.86 -16.75 46.4 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.331 -176.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.15 34.86 13.38 Favored Glycine 0 N--CA 1.427 -1.932 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.77 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -103.42 140.69 37.13 Favored 'General case' 0 N--CA 1.418 -2.03 0 C-N-CA 119.722 -0.791 . . . . 0.0 109.795 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -81.43 23.9 0.59 Allowed 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 114.51 -1.223 . . . . 0.0 113.035 -173.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.593 HD12 ' HG3' ' A' ' 109' ' ' MET . 13.9 mt -69.01 132.86 47.32 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 120.605 0.241 . . . . 0.0 110.517 -175.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.8 p -80.43 167.25 20.41 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.018 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -64.47 -28.69 69.84 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 176.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -65.18 -55.11 20.47 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.788 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -55.67 -51.4 67.38 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 123.848 0.717 . . . . 0.0 110.884 -177.316 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.514 HG21 ' HB2' ' A' ' 106' ' ' ARG . 15.2 m -61.22 -37.31 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.354 -177.474 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -72.51 -44.63 61.95 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.35 0.595 . . . . 0.0 109.709 -178.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.503 ' OE1' ' HD3' ' A' ' 126' ' ' ARG . 4.7 tp10 -67.38 -36.19 80.85 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.253 -176.619 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.442 ' HE2' ' HB1' ' B' ' 84' ' ' ALA . 52.3 mtt -56.13 -54.91 39.4 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.014 174.226 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.6 mm -57.74 -48.52 83.34 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.81 0 O-C-N 124.226 0.954 . . . . 0.0 110.42 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.503 ' HD3' ' OE1' ' A' ' 123' ' ' GLU . 57.0 ttt180 -59.42 -37.86 79.14 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 123.743 0.817 . . . . 0.0 112.494 -176.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -81.65 -25.14 35.86 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 178.169 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.88 -28.88 39.89 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 176.393 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.12 85.35 4.31 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 114.362 -1.29 . . . . 0.0 108.725 173.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 53.9 mt -77.46 -23.9 14.52 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.966 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.35 -176.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -86.5 -10.79 53.36 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 120.503 -0.479 . . . . 0.0 112.197 -175.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.2 41.08 22.64 Favored Glycine 0 C--N 1.317 -0.507 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.474 175.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -101.59 -16.14 16.84 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.73 0.776 . . . . 0.0 109.63 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 96.89 -11.19 66.19 Favored Glycine 0 N--CA 1.441 -0.98 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.471 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -136.36 131.28 34.04 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -178.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.457 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.5 p -80.73 113.65 20.47 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-O 120.817 0.341 . . . . 0.0 111.761 -177.518 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -88.46 178.09 6.64 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.506 ' O ' HG13 ' A' ' 142' ' ' VAL . 85.7 t80 -66.76 -39.89 88.04 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -175.54 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.513 ' O ' HG22 ' A' ' 142' ' ' VAL . 22.5 mm-40 -67.2 -28.82 68.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.321 0.582 . . . . 0.0 110.857 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.11 -33.3 44.48 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.414 0.626 . . . . 0.0 110.367 175.54 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -75.33 -29.87 60.12 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.831 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 139' ' ' GLU . 31.7 m -60.0 -33.48 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-O 121.247 0.546 . . . . 0.0 110.612 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -71.79 -40.15 69.4 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.729 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 95.9 mmm -69.31 -39.08 78.46 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.172 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.401 ' HG2' ' HA ' ' A' ' 85' ' ' ILE . 15.5 tpt . . . . . 0 C--N 1.315 -0.93 0 CA-C-O 121.62 0.724 . . . . 0.0 110.317 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm . . . . . 0 C--O 1.216 -0.71 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.16 -47.59 79.27 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.442 ' HB1' ' HE2' ' A' ' 124' ' ' MET . . . -55.75 -58.79 6.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.26 -1.337 . . . . 0.0 111.723 -178.558 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -67.6 -33.0 74.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -56.13 -57.94 10.03 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 175.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -58.44 -40.31 82.23 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.011 -1.45 . . . . 0.0 110.679 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.1 -54.43 44.71 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.803 0.335 . . . . 0.0 111.312 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 80.9 mt -62.78 -38.97 83.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.548 0.69 . . . . 0.0 109.505 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -58.03 -42.91 86.34 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 124.952 1.301 . . . . 0.0 111.548 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -81.0 -42.73 20.7 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.829 -177.085 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.32 -52.34 9.34 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -175.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 18.0 ttpt . . . . . 0 C--N 1.316 -0.851 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -174.37 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.449 ' HB3' HD11 ' A' ' 9' ' ' ILE . 19.6 tp . . . . . 0 N--CA 1.42 -1.929 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.1 p -85.02 145.14 27.85 Favored 'General case' 0 N--CA 1.413 -2.308 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.574 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.441 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.2 mp0 -51.69 -40.24 59.73 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 125.438 1.495 . . . . 0.0 111.969 -176.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.81 -45.36 89.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.889 -178.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -65.88 -45.85 80.57 Favored 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 176.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.553 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 74.8 mt -57.11 -44.26 82.88 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.352 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.856 -178.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.55 93.6 Favored 'General case' 0 C--O 1.256 1.427 0 CA-C-O 121.393 0.616 . . . . 0.0 111.44 177.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.38 -40.59 96.97 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.664 0.745 . . . . 0.0 109.135 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -73.79 -18.78 60.92 Favored 'General case' 0 C--O 1.189 -2.087 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.509 -178.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.553 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.6 mttt -65.69 -50.78 63.67 Favored 'General case' 0 CA--C 1.504 -0.819 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -45.34 88.4 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.941 177.493 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.68 87.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.607 179.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -61.99 -45.57 93.06 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 m -68.58 -18.1 64.26 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.957 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -67.18 -41.9 85.12 Favored 'General case' 0 C--O 1.243 0.739 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 172.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.428 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 79.3 m-85 -81.44 -50.94 8.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.872 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -63.41 101.34 0.31 Allowed 'General case' 0 CA--C 1.502 -0.887 0 O-C-N 124.293 0.996 . . . . 0.0 109.038 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 19' ' ' PHE . 41.7 mmtm -71.94 -9.09 57.87 Favored 'General case' 0 N--CA 1.423 -1.8 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.265 -174.592 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -107.34 -14.35 14.9 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.55 45.09 90.48 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.516 -0.634 . . . . 0.0 111.516 -176.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -112.74 -15.91 12.88 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 122.621 -0.341 . . . . 0.0 111.59 -175.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.82 16.8 20.75 Favored Glycine 0 N--CA 1.43 -1.708 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.111 179.023 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 68.0 p -142.37 138.67 31.36 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 117.351 0.575 . . . . 0.0 109.804 173.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 67.8 mt -112.99 114.66 47.61 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 176.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.478 HG22 HG22 ' A' ' 62' ' ' THR . 37.2 p -84.41 174.04 10.41 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.162 -177.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.7 p -61.76 -32.83 73.12 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.613 0.721 . . . . 0.0 109.404 174.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -57.56 -55.05 39.9 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 114.639 -1.164 . . . . 0.0 109.051 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -67.23 -39.39 86.2 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.596 -177.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.2 mt -58.38 -50.6 73.1 Favored 'General case' 0 C--O 1.213 -0.821 0 O-C-N 123.133 0.27 . . . . 0.0 111.482 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.09 -30.76 76.24 Favored Glycine 0 C--O 1.214 -1.112 0 C-N-CA 119.488 -1.339 . . . . 0.0 111.836 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.1 m -64.2 -49.45 71.93 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 120.758 0.314 . . . . 0.0 110.456 176.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.1 m -70.22 -37.54 71.75 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.628 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.688 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtt -65.34 -37.74 87.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.73 -0.214 . . . . 0.0 111.09 178.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -63.92 -33.51 75.87 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.932 0.396 . . . . 0.0 110.078 177.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.8 m -71.01 -30.0 66.11 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.482 177.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -84.64 -19.19 33.3 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 110.29 35.74 2.07 Favored Glycine 0 N--CA 1.442 -0.911 0 C-N-CA 120.978 -0.629 . . . . 0.0 114.475 177.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.562 ' HB2' ' NE2' ' B' ' 90' ' ' GLN . 61.3 tt0 -140.06 132.16 27.98 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 171.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -116.49 83.81 13.97 Favored Pre-proline 0 C--N 1.289 -2.052 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.493 ' HG2' HD21 ' A' ' 48' ' ' LEU . 9.3 Cg_endo -86.96 156.64 8.59 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.583 2.189 . . . . 0.0 112.415 -179.066 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.3 t -82.45 158.29 23.3 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mp0 -59.6 -28.87 67.55 Favored 'General case' 0 C--O 1.21 -1.001 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -43.22 82.86 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.063 0.459 . . . . 0.0 110.696 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -69.21 -44.01 72.95 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.814 0.816 . . . . 0.0 109.456 -178.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.493 HD21 ' HG2' ' A' ' 43' ' ' PRO . 87.8 mt -63.72 -40.49 96.88 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.32 -178.371 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -64.33 -37.85 88.96 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.168 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -59.21 -42.43 90.95 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 123.708 0.63 . . . . 0.0 109.981 179.074 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.2 tpp -68.36 -52.99 27.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.949 177.159 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.1 mt -54.76 -49.15 71.06 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.749 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.629 -178.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.421 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 7.8 t30 -58.76 -20.75 52.4 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 123.953 0.901 . . . . 0.0 113.132 -172.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -73.74 -43.02 60.29 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-O 121.214 0.53 . . . . 0.0 110.068 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.678 HG11 ' HB2' ' A' ' 71' ' ' MET . 26.6 m -90.72 -15.41 8.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.896 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.421 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 27.3 t70 -81.57 88.78 6.18 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.681 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.79 -13.16 45.94 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -91.19 -10.33 42.09 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -178.392 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 74.15 29.02 63.12 Favored Glycine 0 N--CA 1.439 -1.106 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.512 177.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -96.35 -16.48 21.27 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 117.607 0.704 . . . . 0.0 111.784 177.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.69 23.34 64.79 Favored Glycine 0 N--CA 1.441 -1.013 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.7 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.478 HG22 HG22 ' A' ' 28' ' ' THR . 15.2 p -138.42 137.24 37.04 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 54.3 mt -89.61 110.37 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.963 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -175.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -79.89 162.6 24.91 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.494 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 68.3 t80 -52.84 -53.02 59.34 Favored Pre-proline 0 C--N 1.307 -1.252 0 CA-C-O 119.061 -0.495 . . . . 0.0 112.155 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -50.99 -42.23 53.28 Favored 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 122.679 2.253 . . . . 0.0 112.715 174.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -68.48 -35.88 78.17 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.265 0.555 . . . . 0.0 110.287 -179.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -66.29 -39.87 89.67 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 85.8 mt -63.21 -44.12 96.19 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.596 176.268 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 57.4 m -55.14 -50.18 69.91 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 123.676 0.61 . . . . 0.0 109.809 176.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.678 ' HB2' HG11 ' A' ' 55' ' ' VAL . 31.5 ttp -59.46 -45.32 91.95 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.603 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 31.8 tpp -67.62 -39.88 84.7 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.27 0.557 . . . . 0.0 110.842 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.11 -24.81 61.54 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.36 -178.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -75.63 -31.73 59.97 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.775 0.798 . . . . 0.0 108.947 172.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -74.46 -54.25 7.93 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.335 -174.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 20.9 ptp . . . . . 0 C--N 1.316 -0.871 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.257 -176.933 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 . . . . . 0 CA--C 1.496 -1.133 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -50.86 -37.41 43.2 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -62.16 -46.03 90.76 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.488 0.661 . . . . 0.0 111.49 175.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.466 HG21 ' HA ' ' A' ' 142' ' ' VAL . 10.0 mm -70.61 -42.44 77.97 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.556 -176.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -69.34 -34.47 74.67 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.517 -1.22 . . . . 0.0 111.562 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.35 -48.62 79.0 Favored 'General case' 0 CA--C 1.495 -1.171 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.471 ' O ' ' HD2' ' A' ' 92' ' ' PHE . . . -61.0 -44.85 96.81 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 113.238 -1.801 . . . . 0.0 110.701 177.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -63.06 -47.31 83.5 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.086 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -58.17 -35.05 71.0 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 178.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.4 HG12 ' O ' ' A' ' 88' ' ' ALA . 7.9 p -76.59 -28.28 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.278 -178.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.471 ' HD2' ' O ' ' A' ' 88' ' ' ALA . 73.8 m-85 -86.63 -42.29 13.56 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.885 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -73.59 85.56 1.59 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.941 0.877 . . . . 0.0 109.411 177.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -79.44 -42.7 24.81 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.952 -175.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.22 -13.03 51.2 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.859 -175.203 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.05 54.57 4.07 Favored Glycine 0 C--N 1.307 -1.075 0 C-N-CA 120.149 -1.024 . . . . 0.0 110.558 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -100.22 -19.96 16.15 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.06 2.03 88.36 Favored Glycine 0 C--O 1.24 0.499 0 N-CA-C 110.24 -1.144 . . . . 0.0 110.24 -177.123 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.515 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 42.4 m-85 -142.22 130.75 22.53 Favored 'General case' 0 N--CA 1.425 -1.686 0 C-N-CA 126.262 1.825 . . . . 0.0 106.38 -178.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.436 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.0 mt -81.19 126.98 39.91 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.6 t -94.33 150.54 20.18 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.68 -44.88 80.61 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.631 0.253 . . . . 0.0 111.136 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.27 -34.87 78.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.414 0.626 . . . . 0.0 109.643 178.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -67.17 -45.97 75.39 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.057 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.9 tt -63.6 -40.0 95.82 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 179.159 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? -61.66 -39.84 92.8 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.298 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -58.32 -49.75 76.08 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.629 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.488 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.9 p -68.06 -30.16 47.13 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.667 0 C-N-CA 120.327 -0.549 . . . . 0.0 109.795 -179.102 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.8 mmt -63.96 -42.25 97.34 Favored 'General case' 0 CA--C 1.491 -1.299 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.7 m -66.4 -32.44 73.82 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -73.56 -29.01 62.16 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.652 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 79.5 mt -91.2 -9.8 44.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.388 0.613 . . . . 0.0 110.165 -178.049 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 75.9 20.37 77.92 Favored Glycine 0 N--CA 1.435 -1.405 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.363 179.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -76.56 -27.53 55.93 Favored 'General case' 0 CA--C 1.495 -1.156 0 CA-C-N 116.98 0.39 . . . . 0.0 110.951 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 59.96 42.64 15.79 Favored 'General case' 0 C--O 1.236 0.362 0 O-C-N 124.32 1.013 . . . . 0.0 111.689 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 58.5 mt -86.27 154.8 21.0 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.476 ' H ' ' CD ' ' A' ' 120' ' ' GLU . 20.7 p -101.78 177.31 4.94 Favored 'General case' 0 N--CA 1.426 -1.626 0 C-N-CA 119.061 -1.056 . . . . 0.0 110.743 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.433 ' HA ' HG22 ' A' ' 121' ' ' VAL . 6.3 p-10 -65.21 -18.55 65.4 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.145 0.498 . . . . 0.0 110.853 -177.685 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -70.69 -57.05 5.09 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.472 -177.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.476 ' CD ' ' H ' ' A' ' 117' ' ' THR . 3.5 pm0 -70.08 -35.52 74.25 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.336 -177.723 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.486 ' O ' HG12 ' A' ' 125' ' ' ILE . 5.9 m -70.93 -26.56 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.42 -178.36 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -72.82 -35.64 67.34 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -67.48 -36.0 80.27 Favored 'General case' 0 C--N 1.352 0.704 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 176.455 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.42 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 65.2 mtt -55.15 -46.56 75.71 Favored 'General case' 0 CA--C 1.509 -0.608 0 O-C-N 124.145 0.903 . . . . 0.0 109.933 176.271 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.486 HG12 ' O ' ' A' ' 121' ' ' VAL . 51.2 mm -66.32 -53.99 30.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.258 177.346 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -45.82 -59.66 2.67 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 126.274 1.83 . . . . 0.0 114.555 -174.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -69.44 -20.08 63.77 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.921 0.391 . . . . 0.0 111.64 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -92.31 -21.26 20.38 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.636 0.732 . . . . 0.0 110.154 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -79.6 73.26 6.3 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 122.323 1.059 . . . . 0.0 110.282 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ILE . . . . . 0.424 ' HB ' ' HG3' ' A' ' 140' ' ' GLU . 27.9 mt -82.98 -9.71 11.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 CA-C-N 114.605 -1.18 . . . . 0.0 108.757 176.496 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -84.8 -11.84 54.9 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.46 0.648 . . . . 0.0 109.537 -178.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 65.7 36.26 92.11 Favored Glycine 0 N--CA 1.436 -1.313 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.453 177.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -101.29 -16.38 16.96 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.329 0.585 . . . . 0.0 110.289 -176.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.15 0.25 68.19 Favored Glycine 0 C--N 1.312 -0.796 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -176.55 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.515 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 96.0 mt-30 -144.36 138.91 28.15 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.436 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.3 p -83.45 118.98 31.93 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -176.255 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.423 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 37.7 t30 -73.8 156.3 37.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.788 1.235 . . . . 0.0 110.489 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.467 ' O ' HG13 ' A' ' 142' ' ' VAL . 80.2 t80 -56.81 -48.79 77.18 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 122.738 0.415 . . . . 0.0 111.725 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.441 ' O ' HG22 ' A' ' 142' ' ' VAL . 27.0 mm-40 -65.98 -33.93 76.94 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.994 0.426 . . . . 0.0 111.971 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.424 ' HG3' ' HB ' ' A' ' 130' ' ' ILE . 1.3 mp0 -71.67 -34.5 69.76 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 121.219 0.533 . . . . 0.0 110.157 175.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -68.34 -42.46 79.24 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.81 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.467 HG13 ' O ' ' A' ' 138' ' ' TYR . 8.9 m -63.58 -36.61 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 120.283 -0.567 . . . . 0.0 109.646 178.424 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -64.7 -49.5 70.64 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.712 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -69.41 -44.61 71.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.515 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.7 tpt . . . . . 0 C--N 1.321 -0.64 0 N-CA-C 111.455 0.169 . . . . 0.0 111.455 -177.627 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt . . . . . 0 C--O 1.216 -0.665 0 CA-C-O 120.335 0.112 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -61.96 -35.72 79.31 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 123.099 0.559 . . . . 0.0 110.273 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.406 ' HB1' ' HE2' ' A' ' 124' ' ' MET . . . -60.25 -55.83 28.95 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.474 179.341 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.565 ' O ' HG12 ' B' ' 89' ' ' ILE . 35.9 m95 -67.43 -37.56 83.21 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 177.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -54.37 -56.78 15.17 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -63.14 -27.83 69.64 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.259 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.36 -55.16 8.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.618 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.565 HG12 ' O ' ' B' ' 85' ' ' TRP . 44.7 mm -57.38 -50.53 76.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.831 0.824 . . . . 0.0 109.188 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 90' ' ' GLN . . . . . 0.562 ' NE2' ' HB2' ' A' ' 41' ' ' GLN . 29.9 tt0 -61.51 -43.29 99.13 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 113.949 -1.478 . . . . 0.0 112.278 -176.268 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -76.15 -31.46 58.58 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.325 -0.55 . . . . 0.0 111.337 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.09 -38.08 89.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.545 0.688 . . . . 0.0 109.621 177.329 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 38.0 mttm . . . . . 0 C--N 1.315 -0.905 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.599 175.603 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.442 ' HB3' HD11 ' A' ' 9' ' ' ILE . 20.1 tp . . . . . 0 N--CA 1.416 -2.132 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.1 p -77.31 151.03 35.19 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.585 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -59.09 -36.1 74.55 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -176.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -58.85 -52.83 64.06 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 121.261 0.553 . . . . 0.0 109.72 177.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -62.58 -46.69 87.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.032 -177.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.515 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 75.2 mt -60.0 -36.71 68.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 O-C-N 123.588 0.555 . . . . 0.0 111.084 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.19 -44.93 86.83 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-O 120.647 0.26 . . . . 0.0 110.527 177.325 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -61.57 -36.63 81.19 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.717 176.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.475 ' CZ ' ' HG2' ' A' ' 72' ' ' MET . 56.0 m-85 -72.32 -33.94 67.71 Favored 'General case' 0 C--O 1.185 -2.323 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 177.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 99.2 mttt -59.03 -42.99 91.54 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.756 0.788 . . . . 0.0 109.794 176.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.34 -54.46 40.17 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.592 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.9 -31.44 69.23 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.042 -176.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -63.11 -48.25 79.33 Favored 'General case' 0 C--O 1.206 -1.237 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 177.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -68.84 -17.33 63.98 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.251 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.6 tp -72.0 -31.8 66.58 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.414 0.626 . . . . 0.0 110.04 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.49 ' CD2' HG21 ' A' ' 35' ' ' VAL . 10.5 m-85 -95.75 -35.86 11.39 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.114 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -77.64 99.38 5.77 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 175.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.69 -21.89 66.85 Favored 'General case' 0 C--N 1.307 -1.251 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -173.138 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.438 ' OD2' ' HB3' ' A' ' 24' ' ' ASP . 7.5 p-10 -113.12 -13.32 13.04 Favored 'General case' 0 C--N 1.305 -1.353 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.517 179.014 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.33 57.01 7.89 Favored Glycine 0 C--O 1.242 0.62 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.686 176.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.438 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 2.9 p-10 -112.91 -13.93 13.09 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 120.956 0.407 . . . . 0.0 110.518 -177.258 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.28 6.95 44.17 Favored Glycine 0 N--CA 1.433 -1.545 0 C-N-CA 121.172 -0.537 . . . . 0.0 112.79 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.447 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 74.6 p -137.78 131.27 30.97 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 117.288 0.544 . . . . 0.0 109.68 175.005 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.3 mt -102.26 124.99 56.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.993 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 177.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 27.0 p -94.3 167.7 11.37 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.294 178.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 40.0 p -64.82 -26.36 68.31 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 120.901 0.381 . . . . 0.0 110.238 177.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -55.32 -60.65 3.11 Favored 'General case' 0 C--O 1.242 0.668 0 C-N-CA 124.16 0.984 . . . . 0.0 108.941 174.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.88 -42.95 98.94 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 113.986 -1.461 . . . . 0.0 109.873 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -56.43 -61.73 2.21 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.878 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.17 -31.84 82.11 Favored Glycine 0 C--N 1.309 -0.969 0 C-N-CA 119.303 -1.427 . . . . 0.0 113.43 -174.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.6 m -67.59 -44.46 78.06 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 116.864 0.332 . . . . 0.0 111.068 178.468 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.514 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 31.3 m -71.48 -35.98 58.84 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 C-N-CA 119.699 -0.801 . . . . 0.0 110.152 178.316 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -64.11 -44.4 92.38 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.866 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -64.69 -33.42 75.9 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.86 0.362 . . . . 0.0 110.198 178.072 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 m -70.77 -21.46 62.5 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.091 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 92.2 mt -88.98 -22.77 22.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.71 0.291 . . . . 0.0 110.45 177.613 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.89 3.44 31.93 Favored Glycine 0 C--N 1.314 -0.693 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.728 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -101.47 131.47 47.58 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -121.47 79.87 37.84 Favored Pre-proline 0 C--N 1.298 -1.658 0 C-N-CA 119.709 -0.796 . . . . 0.0 112.704 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -78.81 153.97 26.2 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 121.703 1.602 . . . . 0.0 108.675 169.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.433 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 47.6 p -81.85 173.33 12.36 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.134 -178.02 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -59.12 -40.76 86.42 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 123.827 0.851 . . . . 0.0 110.658 -176.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.43 -35.87 68.43 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.248 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.433 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 23.0 mm-40 -60.51 -47.97 83.8 Favored 'General case' 0 C--O 1.241 0.607 0 O-C-N 123.502 0.501 . . . . 0.0 110.943 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.444 ' O ' HG13 ' A' ' 52' ' ' ILE . 78.9 mt -62.43 -41.06 98.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.129 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -67.52 -36.57 81.29 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.548 -177.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -67.57 -42.03 83.23 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.013 0.435 . . . . 0.0 109.983 178.516 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.5 tpp -60.06 -36.8 78.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.97 -1.013 . . . . 0.0 109.653 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 48' ' ' LEU . 49.0 mt -65.84 -50.21 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.143 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.4 175.171 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.504 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.0 t30 -60.98 -23.39 65.32 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -174.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.68 -44.4 73.32 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 123.98 0.912 . . . . 0.0 109.238 175.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.8 m -105.6 -15.49 8.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -177.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.504 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 27.7 t0 -72.17 103.8 3.44 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.062 0.458 . . . . 0.0 111.581 -176.283 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.07 -21.61 25.95 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.325 -179.237 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.05 -12.08 57.48 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.277 -174.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 62.8 29.84 75.22 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -173.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -100.12 -8.98 23.05 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.199 0.523 . . . . 0.0 110.853 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 86.82 12.83 68.07 Favored Glycine 0 N--CA 1.432 -1.602 0 CA-C-N 115.856 -0.611 . . . . 0.0 114.018 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.447 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 53.9 p -132.35 150.86 52.07 Favored 'General case' 0 C--O 1.255 1.363 0 CA-C-N 117.919 0.859 . . . . 0.0 111.124 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.405 HG13 HG12 ' A' ' 52' ' ' ILE . 86.1 mt -91.76 112.35 25.45 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.719 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.203 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -80.28 153.11 28.68 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 175.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.421 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 31.2 t80 -53.03 -50.15 83.51 Favored Pre-proline 0 CA--C 1.553 1.096 0 O-C-N 123.429 0.456 . . . . 0.0 111.93 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.1 Cg_endo -49.72 -47.55 22.62 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.653 2.235 . . . . 0.0 112.872 173.507 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -62.74 -41.42 99.17 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 121.786 0.803 . . . . 0.0 110.425 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -61.43 -43.97 97.95 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.382 176.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.6 mt -62.91 -35.11 78.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.937 178.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.9 m -58.68 -53.54 57.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 122.617 0.367 . . . . 0.0 111.191 178.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -64.97 -31.55 72.84 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.856 -177.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.475 ' HG2' ' CZ ' ' A' ' 12' ' ' PHE . 13.1 tpp -79.21 -38.75 34.95 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 119.66 -0.816 . . . . 0.0 110.978 -176.358 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.75 -24.31 62.59 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-O 120.682 0.277 . . . . 0.0 110.942 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -72.34 -27.34 62.35 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 121.244 0.545 . . . . 0.0 110.289 174.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.6 tttp -78.68 -47.76 16.34 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 176.629 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 65.6 mtp . . . . . 0 C--N 1.304 -1.377 0 CA-C-N 113.976 -1.465 . . . . 0.0 110.927 -177.162 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 N--CA 1.439 -1.018 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.54 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 47.5 mt-10 -53.59 -63.4 1.16 Allowed 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -170.05 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -83.95 -21.65 31.73 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 121.739 0.78 . . . . 0.0 109.589 -176.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.4 mm -66.75 -47.33 83.26 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.407 -172.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -73.28 -30.5 63.45 Favored 'General case' 0 N--CA 1.423 -1.82 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.45 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 39.4 mt-10 -64.63 -46.22 83.48 Favored 'General case' 0 C--O 1.247 0.938 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.115 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.455 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -67.68 -42.51 81.99 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.274 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -60.06 -45.63 92.24 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 178.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -60.85 -31.08 70.53 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.649 0.78 . . . . 0.0 112.465 -179.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 88' ' ' ALA . 14.5 p -79.52 -27.27 12.78 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 C-N-CA 119.173 -1.011 . . . . 0.0 111.63 -179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -82.14 -52.53 6.9 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -87.84 81.47 7.56 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 122.558 1.17 . . . . 0.0 108.159 175.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -76.09 -29.71 58.04 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 113.24 -1.8 . . . . 0.0 110.575 -174.012 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -73.97 -13.79 60.93 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.198 0.523 . . . . 0.0 110.72 178.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 66.24 42.83 93.98 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.981 -0.554 . . . . 0.0 113.491 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -98.56 -10.7 23.05 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 122.576 -0.367 . . . . 0.0 111.91 -179.33 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 102.19 4.45 50.55 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.357 -0.925 . . . . 0.0 113.24 174.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -151.99 132.42 13.78 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-O 121.168 0.509 . . . . 0.0 111.266 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.469 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.1 mt -79.11 128.59 38.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 -177.514 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.6 t -113.61 145.32 41.45 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 176.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.49 -50.45 62.71 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -173.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.36 -44.08 84.06 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 123.278 0.361 . . . . 0.0 111.86 -177.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -71.89 -37.74 70.08 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.992 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.491 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.1 tt -60.59 -43.5 97.3 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 178.626 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -64.41 -45.53 87.21 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 23.2 t-80 -59.2 -46.95 87.08 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.391 -178.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.546 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.2 p -66.38 -36.69 77.95 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.131 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.724 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.491 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.5 mmt -59.88 -42.27 93.4 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-O 120.699 0.285 . . . . 0.0 111.552 178.594 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 16.4 m -62.07 -35.42 78.6 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.633 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -74.39 -32.38 62.69 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.371 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.66 HD13 ' HA ' ' B' ' 92' ' ' ALA . 60.9 mt -84.9 -20.14 31.21 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.722 -174.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.68 35.61 6.8 Favored Glycine 0 N--CA 1.423 -2.179 0 C-N-CA 119.773 -1.204 . . . . 0.0 111.792 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.546 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 11.0 tp10 -120.19 111.98 18.51 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 176.455 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -80.28 94.36 6.08 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.767 -178.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.465 HD21 ' HG3' ' A' ' 114' ' ' GLU . 15.0 mt -119.89 132.3 55.51 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 105.735 -1.95 . . . . 0.0 105.735 176.033 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.4 p -94.27 -176.86 4.09 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 118.552 -1.259 . . . . 0.0 109.783 178.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -56.46 -42.07 77.57 Favored 'General case' 0 C--O 1.208 -1.098 0 C-N-CA 123.374 0.67 . . . . 0.0 111.585 -175.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -69.62 -24.7 63.69 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 113.399 0.888 . . . . 0.0 113.399 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -79.43 -46.91 16.63 Favored 'General case' 0 CA--C 1.499 -0.998 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.585 175.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.49 ' O ' HG12 ' A' ' 125' ' ' ILE . 13.9 m -65.67 -34.85 73.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.92 -43.13 99.64 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 123.516 0.726 . . . . 0.0 110.453 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -65.98 -40.93 91.65 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.401 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 64.2 mtt -60.87 -41.05 95.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.235 178.257 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.49 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.0 mm -65.26 -53.03 45.14 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.804 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -56.32 -40.7 74.82 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.359 0.664 . . . . 0.0 112.426 -175.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -79.57 -8.17 58.99 Favored 'General case' 0 C--N 1.309 -1.189 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.505 ' HB1' HG21 ' A' ' 136' ' ' VAL . . . -108.76 -22.58 12.16 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-O 121.3 0.572 . . . . 0.0 110.294 177.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -71.64 95.92 1.51 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 125.087 1.355 . . . . 0.0 109.479 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 63.3 mt -83.74 -48.69 17.05 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.167 -177.075 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -86.13 -11.3 53.0 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -172.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 84.7 66.87 1.44 Allowed Glycine 0 C--N 1.296 -1.647 0 C-N-CA 120.233 -0.984 . . . . 0.0 112.837 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -112.19 -16.35 13.02 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 177.058 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.06 5.41 67.92 Favored Glycine 0 CA--C 1.506 -0.516 0 N-CA-C 109.191 -1.563 . . . . 0.0 109.191 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -151.22 151.25 31.61 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.883 1.673 . . . . 0.0 106.868 -176.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.505 HG21 ' HB1' ' A' ' 128' ' ' ALA . 0.8 OUTLIER -104.28 116.2 47.63 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.971 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -176.689 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -78.49 161.09 27.32 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.528 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.432 ' O ' HG13 ' A' ' 142' ' ' VAL . 81.8 t80 -55.58 -45.24 77.41 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 123.165 0.586 . . . . 0.0 112.045 -177.505 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.418 ' O ' HG22 ' A' ' 142' ' ' VAL . 38.2 mm-40 -66.91 -21.47 65.99 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.117 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -84.32 -38.09 20.81 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 175.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -74.5 -25.03 59.1 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.681 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.432 HG13 ' O ' ' A' ' 138' ' ' TYR . 35.1 m -56.42 -27.94 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-O 121.116 0.484 . . . . 0.0 110.623 176.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -78.11 -64.3 1.19 Allowed 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 176.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 16.2 tpt -57.36 -28.72 63.41 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -171.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.317 -0.828 0 CA-C-O 121.324 0.583 . . . . 0.0 110.028 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 59.6 tttm . . . . . 0 N--CA 1.445 -0.685 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -71.34 -27.26 63.25 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.601 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.53 -53.45 54.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.965 179.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.401 ' CZ2' ' HB3' ' A' ' 124' ' ' MET . 32.2 m95 -67.36 -35.61 79.71 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 177.501 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -52.41 -55.37 22.23 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.181 0.925 . . . . 0.0 108.636 177.12 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -68.17 -38.56 82.21 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-N 114.129 -1.396 . . . . 0.0 112.581 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.35 -50.41 71.58 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -176.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 27.3 pt -72.9 -19.72 18.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.516 0.674 . . . . 0.0 112.456 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -79.16 -49.67 12.21 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-O 121.981 0.896 . . . . 0.0 109.535 175.04 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 91' ' ' LYS . . . . . 0.546 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 18.5 tptm -71.39 -53.97 12.28 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 125.939 1.696 . . . . 0.0 113.596 -175.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 92' ' ' ALA . . . . . 0.66 ' HA ' HD13 ' A' ' 112' ' ' LEU . . . -54.27 -51.92 63.02 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -169.102 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? . . . . . 0 N--CA 1.417 -2.105 0 O-C-N 122.13 -0.356 . . . . 0.0 111.378 -177.072 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.588 0 CA-C-O 120.517 0.199 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -125.46 15.87 8.25 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 121.565 -0.709 . . . . 0.0 109.914 -177.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.588 ' O ' HD13 ' A' ' 4' ' ' LEU . 15.8 pt20 -77.59 124.28 27.72 Favored 'General case' 0 CA--C 1.457 -2.613 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -174.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.588 HD13 ' O ' ' A' ' 3' ' ' GLN . 2.8 mm? -132.79 152.36 51.81 Favored 'General case' 0 N--CA 1.395 -3.203 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.225 168.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.461 ' O ' HG13 ' A' ' 9' ' ' ILE . 27.0 p -88.1 170.09 11.37 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 174.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -64.93 -43.82 91.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -174.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -64.89 -36.56 84.74 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.838 0.827 . . . . 0.0 108.987 178.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.431 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 6.0 tp-100 -62.39 -50.27 72.21 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.349 -1.296 . . . . 0.0 108.983 178.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 5' ' ' THR . 82.5 mt -59.14 -39.7 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.571 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.5 -34.66 77.3 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.151 0.501 . . . . 0.0 111.466 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -74.42 -36.59 63.44 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.431 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 23.7 m-85 -69.19 -31.59 70.31 Favored 'General case' 0 C--O 1.2 -1.509 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.861 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -55.43 -48.18 74.83 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 172.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.81 -58.86 6.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.37 178.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.34 -48.34 62.45 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.381 0.672 . . . . 0.0 111.117 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.428 ' HZ ' ' O ' ' A' ' 25' ' ' GLY . 64.2 t80 -56.1 -44.88 79.48 Favored 'General case' 0 C--O 1.213 -0.816 0 C-N-CA 124.312 1.045 . . . . 0.0 110.892 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.4 m -73.47 -27.44 61.4 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.723 -177.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.62 -34.07 77.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.009 0.433 . . . . 0.0 111.564 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -87.74 -36.59 17.26 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.901 176.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -76.85 87.98 3.44 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-O 122.12 0.962 . . . . 0.0 109.931 176.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.499 ' HE3' ' CG2' ' A' ' 34' ' ' THR . 61.5 mttm -68.66 -28.36 66.81 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.574 -1.193 . . . . 0.0 112.655 -175.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.539 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 23.9 m-20 -82.84 -14.12 54.92 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.541 -0.864 . . . . 0.0 110.539 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.85 44.42 97.09 Favored Glycine 0 CA--C 1.517 0.205 0 O-C-N 123.353 0.408 . . . . 0.0 112.082 -178.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.539 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 4.6 p30 -113.18 -16.45 12.57 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 120.797 0.332 . . . . 0.0 111.018 -176.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.428 ' O ' ' HZ ' ' A' ' 16' ' ' PHE . . . 102.32 4.42 50.17 Favored Glycine 0 N--CA 1.431 -1.646 0 C-N-CA 120.014 -1.088 . . . . 0.0 114.666 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.9 p -138.63 130.77 28.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 118.33 1.065 . . . . 0.0 110.769 172.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 56.6 mt -93.1 128.68 44.43 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 C-N-CA 122.371 0.269 . . . . 0.0 110.368 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 p -101.47 171.51 7.53 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 123.635 0.774 . . . . 0.0 110.149 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 47.1 p -69.19 -24.84 64.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.273 0.559 . . . . 0.0 109.907 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -57.63 -53.08 62.2 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.236 175.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -67.66 -42.8 81.59 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 114.124 -1.398 . . . . 0.0 110.723 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.1 mt -59.67 -54.19 49.25 Favored 'General case' 0 C--O 1.204 -1.303 0 O-C-N 123.767 0.667 . . . . 0.0 110.314 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.91 -27.99 69.54 Favored Glycine 0 C--N 1.313 -0.741 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.035 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.499 ' CG2' ' HE3' ' A' ' 21' ' ' LYS . 58.0 m -75.6 -43.15 49.61 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 116.941 0.371 . . . . 0.0 110.804 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.416 HG13 ' HE2' ' A' ' 21' ' ' LYS . 31.5 m -68.5 -33.98 63.0 Favored 'Isoleucine or valine' 0 C--N 1.344 0.34 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.487 178.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -65.5 -40.63 93.25 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.262 173.189 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -59.8 -48.07 83.15 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 123.137 0.575 . . . . 0.0 110.072 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.3 m -69.51 -21.1 63.7 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.305 0.574 . . . . 0.0 111.041 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.558 HD11 ' O ' ' A' ' 112' ' ' LEU . 3.4 tm? -83.05 -23.2 33.27 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.044 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.73 39.71 3.09 Favored Glycine 0 N--CA 1.433 -1.521 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.512 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -143.96 135.58 26.05 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 -121.76 84.36 43.56 Favored Pre-proline 0 C--N 1.301 -1.515 0 O-C-N 122.167 -0.333 . . . . 0.0 110.193 176.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -76.83 170.87 19.02 Favored 'Trans proline' 0 C--O 1.242 0.721 0 C-N-CA 122.475 2.117 . . . . 0.0 110.163 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.524 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 77.0 p -89.42 164.38 14.88 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.904 -177.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -57.17 -41.66 79.67 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 124.356 1.062 . . . . 0.0 108.45 176.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.92 -42.35 98.98 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.094 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.524 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 7.8 mm-40 -62.92 -47.57 82.69 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 121.211 0.529 . . . . 0.0 110.965 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.4 mt -69.7 -38.12 76.84 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.503 -176.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -64.45 -45.57 86.88 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -61.47 -44.14 97.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.404 177.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 51.3 tpp -55.63 -44.09 76.79 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.016 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.7 mt -65.02 -56.26 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.569 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.448 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.5 t30 -58.92 -23.7 61.57 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -172.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -66.5 -38.77 87.97 Favored 'General case' 0 N--CA 1.386 -3.663 0 C-N-CA 123.122 0.569 . . . . 0.0 111.679 175.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.627 HG11 ' SD ' ' A' ' 71' ' ' MET . 8.6 m -95.87 -18.79 6.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 120.838 0.351 . . . . 0.0 110.454 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.448 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 38.4 t70 -70.62 89.84 0.74 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.67 -178.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.37 -27.11 23.0 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.207 -176.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -82.23 -11.71 58.51 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.384 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.08 17.98 79.69 Favored Glycine 0 N--CA 1.434 -1.451 0 CA-C-O 119.457 -0.635 . . . . 0.0 114.228 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.0 p30 -81.39 -16.31 52.59 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.043 1.421 . . . . 0.0 111.871 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.78 4.71 58.94 Favored Glycine 0 N--CA 1.441 -0.968 0 C-N-CA 120.545 -0.836 . . . . 0.0 114.027 177.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.0 p -135.78 166.77 22.52 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 117.909 0.855 . . . . 0.0 111.198 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.3 mt -91.27 111.62 24.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -89.66 161.4 16.13 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 176.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.426 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 37.1 t80 -58.5 -50.11 89.85 Favored Pre-proline 0 CA--C 1.553 1.086 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.5 Cg_endo -49.23 -41.92 41.06 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.853 2.368 . . . . 0.0 112.479 174.003 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -70.64 -41.06 72.67 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.517 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.692 ' CZ ' ' HA ' ' B' ' 100' ' ' ALA . 1.4 t80 -59.23 -45.0 92.31 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.729 174.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.51 -45.7 80.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.338 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.519 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 43.5 m -57.35 -54.32 48.18 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 123.618 0.574 . . . . 0.0 110.816 174.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.627 ' SD ' HG11 ' A' ' 55' ' ' VAL . 35.6 ttp -53.69 -51.72 62.32 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 123.737 0.815 . . . . 0.0 112.035 -178.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.406 ' HG2' ' CE1' ' A' ' 12' ' ' PHE . 34.2 tpp -67.74 -43.27 80.31 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.097 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.65 -28.88 69.7 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 123.726 0.641 . . . . 0.0 111.54 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 70' ' ' THR . 51.6 mtp180 -79.21 -36.39 40.23 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.177 177.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -72.79 -30.66 64.27 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 121.465 0.65 . . . . 0.0 110.809 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.447 ' HG3' ' HD2' ' A' ' 148' ' ' LYS . 56.6 ttp -84.14 -16.31 44.02 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.684 -176.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -142.16 -74.63 0.3 Allowed 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 119.688 -0.805 . . . . 0.0 112.216 -175.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -153.86 142.33 20.71 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 117.67 0.214 . . . . 0.0 110.459 -178.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.454 ' HA ' ' HE ' ' A' ' 74' ' ' ARG . 0.9 OUTLIER -79.51 -29.55 41.58 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 168.434 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.0 t70 176.65 -55.06 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 112.465 -2.152 . . . . 0.0 106.307 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.4 p -108.44 -173.32 2.25 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 113.68 -1.6 . . . . 0.0 110.54 -177.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -76.51 11.9 1.45 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.946 0.899 . . . . 0.0 112.66 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -51.36 -50.71 58.97 Favored 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.333 0.653 . . . . 0.0 111.778 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 74' ' ' ARG . 8.2 mm-40 -60.03 -35.32 74.84 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.46 -176.291 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.44 HG21 HG12 ' A' ' 142' ' ' VAL . 30.3 mm -74.97 -45.04 43.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.732 -177.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -71.48 -35.86 70.96 Favored 'General case' 0 C--O 1.21 -1.021 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.401 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.426 ' CD ' HH21 ' A' ' 90' ' ' ARG . 5.6 mm-40 -61.91 -35.89 79.7 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.637 0.256 . . . . 0.0 111.597 175.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.431 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -68.64 -44.3 74.46 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 176.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -59.9 -41.67 92.17 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 121.317 0.579 . . . . 0.0 109.533 178.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.426 HH21 ' CD ' ' A' ' 87' ' ' GLU . 7.0 tmm_? -61.7 -36.82 82.0 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 125.356 1.462 . . . . 0.0 111.822 -178.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.464 HG11 ' O ' ' B' ' 92' ' ' ALA . 9.6 p -80.43 -19.01 12.05 Favored 'Isoleucine or valine' 0 C--O 1.248 0.982 0 CA-C-O 121.589 0.709 . . . . 0.0 111.066 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -88.06 -54.3 4.29 Favored 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 120.025 -0.67 . . . . 0.0 111.467 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -104.07 87.57 2.8 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.049 0.452 . . . . 0.0 110.373 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.407 ' N ' ' HD3' ' A' ' 94' ' ' LYS . 3.3 mppt? -80.11 -28.13 39.06 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.525 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -77.44 -13.24 59.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.127 -171.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.7 62.46 3.01 Favored Glycine 0 N--CA 1.431 -1.645 0 C-N-CA 120.091 -1.052 . . . . 0.0 111.542 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -96.7 -18.64 19.53 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 176.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.86 -5.01 85.9 Favored Glycine 0 N--CA 1.441 -1.0 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -177.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.604 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 61.1 m-85 -143.54 143.36 31.5 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 -178.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.482 ' HB ' HG13 ' A' ' 136' ' ' VAL . 6.3 mt -80.22 125.2 38.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.759 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.6 m -95.57 140.06 30.94 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.13 -40.25 97.05 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.576 0.35 . . . . 0.0 111.532 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.57 -37.06 80.06 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.05 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 67.5 tt0 -77.3 -36.83 53.79 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.662 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.9 tt -66.55 -36.8 83.56 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.443 ' HB2' HG21 ' A' ' 121' ' ' VAL . 2.7 tmt_? -62.0 -40.82 96.94 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -64.36 -44.95 89.83 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.328 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.564 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.2 p -66.51 -32.3 57.45 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.172 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.421 ' HG3' HD12 ' A' ' 116' ' ' LEU . 20.5 mmt -64.39 -40.12 95.2 Favored 'General case' 0 CA--C 1.5 -0.965 0 N-CA-C 111.89 0.329 . . . . 0.0 111.89 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.4 m -62.52 -35.85 80.72 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -74.45 -28.94 61.26 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.913 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 70.4 mt -90.64 -14.87 31.49 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 121.139 0.495 . . . . 0.0 110.25 -176.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.58 3.47 86.33 Favored Glycine 0 N--CA 1.436 -1.346 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.889 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.532 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 24.0 mm-40 -70.67 -30.46 67.06 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.981 0.39 . . . . 0.0 110.01 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 51.93 86.6 0.04 OUTLIER 'General case' 0 C--O 1.246 0.91 0 O-C-N 124.594 1.184 . . . . 0.0 112.569 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.421 HD12 ' HG3' ' A' ' 109' ' ' MET . 62.4 mt -113.05 148.8 34.43 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.217 -178.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 9.4 p -77.09 165.21 24.9 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.993 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.9 -40.29 97.11 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.46 -35.64 81.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.891 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.77 -55.65 16.14 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.701 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.443 HG21 ' HB2' ' A' ' 106' ' ' ARG . 15.1 m -64.16 -33.13 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.421 -178.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -63.85 -43.13 97.07 Favored 'General case' 0 CA--C 1.507 -0.68 0 C-N-CA 123.193 0.597 . . . . 0.0 109.642 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -67.36 -43.66 80.9 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.907 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.51 ' HA ' ' CZ ' ' B' ' 81' ' ' PHE . 62.8 mtt -57.8 -48.9 78.39 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.941 177.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.4 mm -64.26 -43.38 97.23 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.579 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.556 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -56.24 -44.32 79.52 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 123.09 0.556 . . . . 0.0 112.182 -176.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -71.56 -31.74 67.32 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 119.924 -0.711 . . . . 0.0 110.88 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.463 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -79.5 -30.51 42.0 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.645 -178.054 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -72.47 91.91 1.42 Allowed 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 124.454 1.102 . . . . 0.0 108.07 173.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 68.2 mt -81.72 -42.41 19.27 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.786 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.274 -173.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -79.54 -12.05 59.87 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.892 -176.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.35 50.45 5.07 Favored Glycine 0 C--N 1.31 -0.911 0 C-N-CA 120.431 -0.89 . . . . 0.0 113.609 175.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -100.27 -15.54 18.02 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 122.074 0.94 . . . . 0.0 108.51 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 94.5 -0.1 65.33 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.604 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 96.2 mt-30 -142.29 140.92 32.35 Favored 'General case' 0 N--CA 1.429 -1.52 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 -178.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.482 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.6 OUTLIER -99.1 122.17 50.54 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -175.526 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.462 ' ND2' ' HG3' ' A' ' 140' ' ' GLU . 0.5 OUTLIER -85.56 171.75 11.48 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.941 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.61 ' O ' HG13 ' A' ' 142' ' ' VAL . 75.2 t80 -54.57 -47.0 73.81 Favored 'General case' 0 C--O 1.219 -0.502 0 C-N-CA 123.225 0.61 . . . . 0.0 112.325 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.76 -23.67 67.46 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.072 0.463 . . . . 0.0 112.095 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.462 ' HG3' ' ND2' ' A' ' 137' ' ' ASN . 44.5 mt-10 -86.89 -37.86 17.28 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-O 121.713 0.768 . . . . 0.0 108.977 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -70.34 -30.47 67.43 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.3 -0.864 . . . . 0.0 112.102 -179.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.61 HG13 ' O ' ' A' ' 138' ' ' TYR . 28.9 m -59.83 -35.01 57.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -76.96 -34.11 57.62 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.644 0.735 . . . . 0.0 109.41 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.463 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 92.6 mmm -76.24 -35.65 58.88 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.403 -176.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 14.6 tpt -65.13 -38.64 91.29 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.354 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 8.2 m -82.46 -9.45 59.43 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-O 121.544 0.688 . . . . 0.0 110.71 -179.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -88.33 78.08 8.05 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.372 0.606 . . . . 0.0 110.6 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.478 ' HD3' ' HA ' ' B' ' 86' ' ' LYS . 57.1 mttm . . . . . 0 C--N 1.307 -1.278 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 N--CA 1.434 -1.239 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -76.67 -176.11 2.97 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 123.176 2.584 . . . . 0.0 113.234 -177.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -145.41 88.99 1.89 Allowed 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -132.29 -35.79 1.16 Allowed 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -176.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 7.2 m -55.25 -63.34 1.19 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.108 0.563 . . . . 0.0 111.034 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -113.37 -22.64 10.3 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 177.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 72.3 t60 71.16 -59.69 0.54 Allowed 'General case' 0 C--O 1.216 -0.659 0 C-N-CA 125.88 1.672 . . . . 0.0 111.926 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 81' ' ' PHE . . . . . 0.51 ' CZ ' ' HA ' ' A' ' 124' ' ' MET . 16.2 t80 -60.01 -54.37 46.83 Favored 'General case' 0 C--O 1.203 -1.366 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -178.154 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -57.19 -47.11 82.08 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 124.0 0.813 . . . . 0.0 111.383 -176.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' B' ' 86' ' ' LYS . 1.6 mp0 -66.43 -41.91 88.49 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 178.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -69.8 -41.78 74.58 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.99 0.424 . . . . 0.0 110.47 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 77.3 t-105 -66.31 -22.72 66.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 122.673 1.225 . . . . 0.0 109.196 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 86' ' ' LYS . . . . . 0.544 ' O ' ' HG3' ' B' ' 90' ' ' GLN . 85.2 tttt -78.97 -63.59 1.38 Allowed 'General case' 0 C--N 1.267 -3.016 0 CA-C-N 115.049 -0.978 . . . . 0.0 108.808 174.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 87' ' ' HIS . . . . . 0.404 ' HA ' ' OE1' ' B' ' 90' ' ' GLN . 31.1 m170 -63.71 -52.14 61.87 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -170.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.12 -29.94 69.82 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.164 0.507 . . . . 0.0 111.126 -176.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 42.8 mm -83.14 -28.62 7.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.22 -178.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 90' ' ' GLN . . . . . 0.544 ' HG3' ' O ' ' B' ' 86' ' ' LYS . 50.7 mt-30 -62.65 -46.48 88.02 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 174.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.532 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 24.6 tptm -64.68 -25.91 68.15 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.082 -1.417 . . . . 0.0 112.164 -178.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.464 ' O ' HG11 ' A' ' 91' ' ' VAL . . . -76.83 -10.85 59.66 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -176.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -60.93 -28.82 69.22 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -172.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -145.59 165.36 28.88 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.52 ' HB2' ' HD3' ' B' ' 96' ' ' PRO . 1.7 mpt? -64.7 -57.65 15.9 Favored Pre-proline 0 C--O 1.219 -0.527 0 C-N-CA 120.244 -0.582 . . . . 0.0 110.02 173.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.52 ' HD3' ' HB2' ' B' ' 95' ' ' MET . 18.9 Cg_endo -97.01 60.97 0.11 Allowed 'Trans proline' 0 C--N 1.37 1.702 0 C-N-CA 122.081 1.854 . . . . 0.0 108.491 174.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -83.47 125.71 73.27 Favored Pre-proline 0 C--N 1.315 -0.93 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.902 -173.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -91.6 117.9 0.49 Allowed 'Trans proline' 0 N--CA 1.417 -3.026 0 C-N-CA 122.027 1.818 . . . . 0.0 110.578 172.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 37.8 p-90 -90.01 12.77 16.61 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-O 122.032 0.92 . . . . 0.0 109.077 174.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' ALA . . . . . 0.692 ' HA ' ' CZ ' ' A' ' 68' ' ' PHE . . . . . . . . 0 N--CA 1.401 -2.925 0 N-CA-C 104.872 -2.27 . . . . 0.0 104.872 176.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.285 0 CA-C-O 120.957 0.408 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -94.02 81.47 4.13 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.464 0.65 . . . . 0.0 110.28 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -128.06 97.52 4.81 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.782 178.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.439 ' HB3' HD11 ' A' ' 9' ' ' ILE . 8.9 tp -129.96 130.26 44.83 Favored 'General case' 0 N--CA 1.42 -1.963 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.23 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.6 p -73.17 151.47 41.5 Favored 'General case' 0 N--CA 1.424 -1.727 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.271 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -53.92 -43.12 69.47 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -173.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -70.0 -33.38 71.96 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.853 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -61.64 -48.89 78.83 Favored 'General case' 0 C--O 1.212 -0.884 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 175.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.459 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 43.3 mt -60.51 -33.66 55.25 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.683 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.601 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.428 ' O ' ' HB2' ' A' ' 13' ' ' LYS . . . -65.29 -41.05 94.53 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.534 0.683 . . . . 0.0 110.25 175.558 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -65.88 -37.78 87.04 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.355 0.598 . . . . 0.0 109.634 175.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.538 ' HZ ' ' SD ' ' A' ' 76' ' ' MET . 46.4 m-85 -69.67 -25.05 63.71 Favored 'General case' 0 C--O 1.176 -2.791 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.885 177.298 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 33.1 mmtp -60.28 -47.78 84.56 Favored 'General case' 0 C--O 1.25 1.125 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 172.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.55 -55.39 20.8 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.379 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.89 82.32 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.166 -0.925 . . . . 0.0 113.136 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -65.6 -45.79 81.82 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -69.14 -16.92 63.76 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.681 -177.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.48 -42.27 99.36 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 171.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.416 ' CD2' HG21 ' A' ' 35' ' ' VAL . 65.4 m-85 -81.32 -51.36 8.45 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.825 178.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -70.64 98.89 1.57 Allowed 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.801 0.81 . . . . 0.0 110.551 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mmtm -77.56 -15.82 59.01 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 114.793 -1.094 . . . . 0.0 113.366 -174.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.482 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 11.1 m-20 -95.42 -14.38 23.84 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.648 -176.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.26 40.34 87.59 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.482 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 5.5 p30 -113.12 -15.23 12.82 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -175.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.23 14.08 60.91 Favored Glycine 0 C--N 1.313 -0.696 0 C-N-CA 120.961 -0.637 . . . . 0.0 113.539 178.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.5 p -134.76 131.39 37.5 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 174.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.8 mt -104.72 121.34 56.45 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.3 p -92.74 171.99 8.64 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.689 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.4 HG23 HD12 ' A' ' 52' ' ' ILE . 11.7 p -59.81 -35.34 74.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.558 0.694 . . . . 0.0 109.648 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -54.43 -51.0 66.33 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.109 1.364 . . . . 0.0 110.506 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -70.84 -36.38 72.86 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.272 -175.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 85.5 mt -61.65 -51.22 69.36 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 175.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.1 -29.45 74.45 Favored Glycine 0 N--CA 1.441 -1.021 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.428 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -61.18 -53.28 58.88 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 116.975 0.388 . . . . 0.0 110.433 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.416 HG21 ' CD2' ' A' ' 19' ' ' PHE . 33.9 m -71.02 -31.54 45.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.349 -177.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.451 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 64.9 mtt -68.14 -37.74 81.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.221 177.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -65.11 -31.9 73.34 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 177.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.6 m -75.33 -13.86 60.44 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.545 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -104.57 6.14 34.35 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.167 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.02 23.14 64.32 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 116.0 -0.545 . . . . 0.0 113.524 178.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.505 ' HG3' ' HD3' ' A' ' 43' ' ' PRO . 5.4 tp-100 -120.8 131.53 54.51 Favored 'General case' 0 N--CA 1.424 -1.754 0 O-C-N 122.226 -0.573 . . . . 0.0 110.474 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -123.29 79.32 53.11 Favored Pre-proline 0 C--N 1.296 -1.737 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.505 ' HD3' ' HG3' ' A' ' 41' ' ' GLN . 31.8 Cg_exo -65.89 164.24 27.89 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 122.188 1.925 . . . . 0.0 110.84 176.212 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.436 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 46.9 p -76.75 166.02 23.94 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 -179.002 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -60.07 -36.47 77.42 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.89 -45.78 93.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.66 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.436 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 34.1 mm-40 -60.49 -43.45 96.98 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.443 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.05 -46.8 76.49 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.95 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 47.1 tp60 -68.64 -42.65 77.68 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -61.39 -42.24 98.4 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.375 0.607 . . . . 0.0 109.854 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 45.0 ttm -54.31 -46.85 72.91 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.506 177.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.4 HD12 HG23 ' A' ' 29' ' ' THR . 40.2 mt -67.54 -53.61 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.178 178.442 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.401 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 12.7 t30 -54.99 -27.54 44.98 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -172.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -66.65 -42.3 86.87 Favored 'General case' 0 N--CA 1.386 -3.658 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 178.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.458 HG11 ' SD ' ' A' ' 71' ' ' MET . 4.3 m -94.82 -14.59 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-O 120.863 0.363 . . . . 0.0 111.321 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.401 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 54.0 t0 -69.28 104.83 2.33 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.54 -35.61 22.74 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.364 -173.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -91.01 -10.55 41.86 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.593 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.65 52.21 36.06 Favored Glycine 0 C--O 1.239 0.429 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.768 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -107.69 -13.89 14.93 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.537 0.208 . . . . 0.0 111.452 -178.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.9 -3.27 33.79 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.239 -0.982 . . . . 0.0 113.563 179.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.9 p -127.83 151.25 49.28 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 117.504 0.652 . . . . 0.0 110.84 178.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.1 mt -91.58 104.69 15.78 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.086 0 N-CA-C 104.198 -2.519 . . . . 0.0 104.198 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.13 158.82 20.29 Favored 'General case' 0 C--N 1.283 -2.303 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -175.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.426 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 52.0 t80 -51.46 -51.69 66.85 Favored Pre-proline 0 CA--C 1.554 1.122 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -176.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.41 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 8.5 Cg_endo -50.52 -44.57 39.18 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.774 2.316 . . . . 0.0 112.838 175.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -69.04 -36.94 78.27 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.537 0.684 . . . . 0.0 110.304 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -63.54 -39.64 94.94 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.092 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 87.2 mt -65.86 -44.02 86.67 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.141 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 93.2 m -54.99 -49.12 72.27 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 123.867 0.73 . . . . 0.0 109.656 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.458 ' SD ' HG11 ' A' ' 55' ' ' VAL . 17.9 ttp -54.41 -52.76 60.71 Favored 'General case' 0 C--O 1.199 -1.591 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.861 176.05 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.0 mmt -64.23 -42.67 96.46 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -174.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.39 -35.25 71.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.625 0.726 . . . . 0.0 110.486 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.516 ' HB3' ' OG1' ' A' ' 79' ' ' THR . 66.4 mtp180 -83.8 -32.79 25.16 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.126 178.055 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -83.29 -35.57 25.17 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 123.077 0.551 . . . . 0.0 112.22 -168.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.538 ' SD ' ' HZ ' ' A' ' 12' ' ' PHE . 63.6 mtm -80.4 -40.78 25.82 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.489 0.662 . . . . 0.0 110.542 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -81.09 -23.41 38.45 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.806 -1.088 . . . . 0.0 113.008 -173.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.4 t70 84.66 124.57 0.04 OUTLIER 'General case' 0 CA--C 1.487 -1.476 0 C-N-CA 125.544 1.538 . . . . 0.0 107.789 -167.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.516 ' OG1' ' HB3' ' A' ' 74' ' ' ARG . 22.2 m -76.13 -67.98 0.63 Allowed 'General case' 0 N--CA 1.409 -2.52 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.525 -172.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.498 ' OD1' ' HB3' ' A' ' 82' ' ' GLU . 21.1 t70 -141.24 -19.18 0.79 Allowed 'General case' 0 C--N 1.275 -2.662 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.894 -172.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.557 ' O ' HG12 ' A' ' 85' ' ' ILE . 50.4 m 75.5 -55.78 0.62 Allowed 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 125.17 1.388 . . . . 0.0 110.62 -176.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.498 ' HB3' ' OD1' ' A' ' 80' ' ' ASP . 20.0 tp10 -58.71 -48.73 80.14 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.271 0.628 . . . . 0.0 109.751 179.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -64.73 -27.45 68.92 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 121.056 0.455 . . . . 0.0 111.542 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.66 -27.25 55.54 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.858 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.557 HG12 ' O ' ' A' ' 81' ' ' SER . 27.2 mm -72.32 -38.61 61.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 174.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -61.74 -42.77 99.4 Favored 'General case' 0 C--O 1.21 -0.996 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.296 174.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -56.33 -51.75 67.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.432 ' HA ' HG12 ' A' ' 91' ' ' VAL . . . -59.04 -43.64 91.68 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.197 179.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.36 -54.02 49.18 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.68 -43.67 69.09 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 125.166 1.386 . . . . 0.0 112.707 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.432 HG12 ' HA ' ' A' ' 88' ' ' ALA . 11.9 p -72.15 -25.94 24.28 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.536 -176.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -82.06 -56.07 4.18 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 175.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -84.23 85.07 7.41 Favored 'General case' 0 C--O 1.252 1.212 0 CA-C-O 122.124 0.964 . . . . 0.0 110.663 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -78.65 -35.02 45.97 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 114.447 -1.251 . . . . 0.0 112.798 -178.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -73.32 -13.57 61.14 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 121.186 0.517 . . . . 0.0 111.003 -178.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.63 52.6 9.62 Favored Glycine 0 N--CA 1.43 -1.715 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -87.94 -18.62 28.72 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.22 6.07 88.34 Favored Glycine 0 CA--C 1.501 -0.805 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.558 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 98.5 m-85 -147.34 149.85 33.6 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 -178.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.51 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.9 mt -93.48 123.3 45.52 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.875 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 175.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 29.9 t -104.06 151.94 22.65 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 123.723 0.809 . . . . 0.0 109.451 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.31 -34.91 79.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.776 178.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.25 86.23 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.089 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.561 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 2.1 tp10 -68.33 -41.17 81.19 Favored 'General case' 0 CA--C 1.503 -0.856 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.437 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -61.43 -39.32 90.37 Favored 'General case' 0 N--CA 1.427 -1.601 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -175.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.708 ' HG3' HG21 ' A' ' 121' ' ' VAL . 19.5 mtm180 -56.65 -42.8 79.57 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.401 172.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.561 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 50.3 m170 -54.52 -56.04 22.97 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.584 0.753 . . . . 0.0 110.697 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.406 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.2 p -70.94 -35.65 60.5 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.137 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.187 -174.353 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 22.7 mmt -63.49 -45.28 91.44 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -177.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.8 p -65.23 -36.01 82.82 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-O 121.135 0.493 . . . . 0.0 110.129 176.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -66.0 -32.58 74.14 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.696 178.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 78.9 mt -85.05 -17.91 36.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.824 -177.406 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 80.33 23.84 60.16 Favored Glycine 0 N--CA 1.435 -1.414 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.451 -177.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -84.99 -35.22 22.11 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 55.4 tptt 47.58 88.25 0.02 OUTLIER 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.648 1.579 . . . . 0.0 113.611 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 64.6 mt -101.06 155.63 17.88 Favored 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 24.3 p -75.78 166.09 24.06 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 175.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -63.52 -34.14 77.14 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -64.13 -44.58 91.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.159 176.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.464 ' HG3' ' CE2' ' B' ' 81' ' ' PHE . 14.2 tt0 -70.5 -35.66 73.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.855 -174.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.708 HG21 ' HG3' ' A' ' 106' ' ' ARG . 19.2 m -72.52 -33.27 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.897 176.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -70.94 -41.86 70.57 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.284 -177.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.524 ' HB2' ' CZ ' ' B' ' 81' ' ' PHE . 48.9 mm-40 -68.55 -31.08 70.04 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.016 177.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.4 mtt -58.8 -48.53 80.96 Favored 'General case' 0 CA--C 1.497 -1.071 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.263 175.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.11 -46.57 96.18 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.533 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.656 178.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -55.67 -44.41 77.26 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.25 0.62 . . . . 0.0 111.48 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -66.17 -28.82 69.07 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.094 0.558 . . . . 0.0 111.37 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.478 ' HB1' HG21 ' A' ' 136' ' ' VAL . . . -97.52 -20.57 17.64 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.624 -0.431 . . . . 0.0 112.05 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.404 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 5.4 t70 -70.24 93.22 0.82 Allowed 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 124.052 0.941 . . . . 0.0 110.244 177.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.1 mt -84.53 -40.31 15.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.229 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -83.76 -10.99 57.72 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.259 0.552 . . . . 0.0 112.305 -172.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.404 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 75.64 55.75 4.87 Favored Glycine 0 C--N 1.307 -1.083 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.587 176.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -111.84 -17.08 13.02 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 177.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.32 4.62 60.94 Favored Glycine 0 N--CA 1.439 -1.136 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.558 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 96.4 mt-30 -147.76 145.12 28.69 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.51 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.0 OUTLIER -102.81 120.4 52.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -176.094 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -86.05 168.3 14.22 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.433 ' O ' HG13 ' A' ' 142' ' ' VAL . 68.2 t80 -55.62 -46.83 77.33 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.971 0.909 . . . . 0.0 112.852 -174.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.476 ' HA ' HG22 ' A' ' 142' ' ' VAL . 28.9 mm-40 -67.45 -26.61 66.48 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -178.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -73.62 -44.87 55.88 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -63.95 -38.7 92.04 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.759 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.476 HG22 ' HA ' ' A' ' 139' ' ' GLU . 15.9 m -66.85 -35.02 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.633 177.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -72.73 -37.98 67.56 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.412 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 1.5 tmt? -72.54 -50.88 22.6 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.917 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -35.67 79.44 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.167 0.587 . . . . 0.0 110.548 -174.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 17.0 m -80.55 -6.33 58.08 Favored 'General case' 0 CA--C 1.561 1.376 0 CA-C-O 121.583 0.706 . . . . 0.0 110.745 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -120.27 19.35 12.16 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 122.364 1.078 . . . . 0.0 109.919 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.409 ' HE3' ' HB3' ' A' ' 148' ' ' LYS . 12.0 ttpp . . . . . 0 C--N 1.278 -2.51 0 CA-C-N 113.858 -1.519 . . . . 0.0 108.281 -178.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.448 -0.527 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -80.75 -25.68 4.19 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 122.765 2.31 . . . . 0.0 112.683 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.29 -6.77 52.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.759 0.314 . . . . 0.0 110.424 -178.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 67.99 82.13 0.18 Allowed 'General case' 0 C--O 1.25 1.094 0 C-N-CA 124.741 1.216 . . . . 0.0 110.19 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 16.3 m -67.08 -22.4 65.84 Favored 'General case' 0 C--N 1.307 -1.239 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.347 -177.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -69.7 -51.05 37.91 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -63.34 -47.23 83.04 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.349 -0.842 . . . . 0.0 109.265 177.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 81' ' ' PHE . . . . . 0.524 ' CZ ' ' HB2' ' A' ' 123' ' ' GLU 0.322 64.4 m-85 -74.41 -16.27 60.89 Favored 'General case' 0 N--CA 1.422 -1.86 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 -175.976 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -71.66 -28.93 64.07 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 176.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -77.16 -45.08 27.94 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 175.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' B' ' 81' ' ' PHE . . . -57.73 -49.98 74.76 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.512 179.433 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -60.22 -38.14 82.47 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -63.38 -29.97 71.18 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 121.364 0.602 . . . . 0.0 110.897 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -84.12 -43.56 14.91 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.091 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.0 -56.76 18.05 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 123.732 0.813 . . . . 0.0 112.312 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 74.2 mt -62.15 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.086 0.469 . . . . 0.0 110.672 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -66.64 -36.31 82.28 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.286 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -73.16 -38.58 66.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.37 -41.2 94.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.978 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -72.23 -7.13 47.63 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.079 0.466 . . . . 0.0 110.034 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 94' ' ' HIS . . . . . 0.41 ' CB ' ' HB2' ' B' ' 97' ' ' ASP . 31.3 m170 83.04 123.65 0.04 OUTLIER 'General case' 0 CA--C 1.504 -0.817 0 C-N-CA 127.001 2.12 . . . . 0.0 113.386 177.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.51 ' HB2' ' HD3' ' B' ' 96' ' ' PRO . 84.8 mtp -90.9 -51.1 0.32 Allowed Pre-proline 0 C--N 1.314 -0.966 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.628 171.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.51 ' HD3' ' HB2' ' B' ' 95' ' ' MET . 16.2 Cg_exo -70.89 98.59 0.8 Allowed 'Trans proline' 0 C--N 1.389 2.703 0 N-CA-C 106.627 -2.105 . . . . 0.0 106.627 164.37 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 97' ' ' ASP . . . . . 0.41 ' HB2' ' CB ' ' B' ' 94' ' ' HIS . 15.5 t70 -170.22 159.44 6.36 Favored Pre-proline 0 C--N 1.296 -1.726 0 N-CA-C 105.489 -2.041 . . . . 0.0 105.489 -167.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -62.35 85.22 0.1 Allowed 'Trans proline' 0 N--CA 1.45 -1.082 0 C-N-CA 122.035 1.824 . . . . 0.0 111.596 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 6.0 t-105 -114.83 99.18 7.29 Favored 'General case' 0 N--CA 1.413 -2.298 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.289 -2.064 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.093 -177.535 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.712 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.493 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 8.9 p-10 -154.38 12.28 0.41 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.093 0.473 . . . . 0.0 111.114 -178.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -119.03 138.37 52.89 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.252 0.549 . . . . 0.0 110.097 -175.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.605 ' HB3' ' HB2' ' A' ' 8' ' ' GLN . 2.9 mm? -131.31 175.29 9.25 Favored 'General case' 0 N--CA 1.416 -2.156 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.265 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.437 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 25.0 p -79.96 160.89 25.78 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -62.19 -31.4 71.91 Favored 'General case' 0 C--O 1.203 -1.375 0 C-N-CA 121.218 -0.193 . . . . 0.0 110.754 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 11' ' ' GLU . 1.8 mp0 -63.41 -42.34 98.76 Favored 'General case' 0 C--N 1.314 -0.974 0 O-C-N 123.5 0.5 . . . . 0.0 111.057 177.285 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.605 ' HB2' ' HB3' ' A' ' 4' ' ' LEU . 27.6 mm-40 -64.67 -47.9 76.73 Favored 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.8 mt -56.8 -39.33 63.58 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.31 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.4 89.58 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 123.521 0.728 . . . . 0.0 111.069 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 7' ' ' GLU . 60.2 mm-40 -61.85 -44.34 97.03 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.554 0.692 . . . . 0.0 109.444 176.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -68.28 -29.76 68.62 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.444 -178.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -68.42 -33.54 74.39 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.982 175.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -68.49 -50.03 55.36 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.7 -43.09 72.2 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.771 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.41 ' HZ ' ' C ' ' A' ' 25' ' ' GLY . 70.2 t80 -59.17 -44.0 92.14 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.777 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.5 m -74.52 -20.87 59.81 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.733 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.256 2.9 tm? -68.67 -50.65 49.38 Favored 'General case' 0 CA--C 1.483 -1.63 0 N-CA-C 106.198 -1.779 . . . . 0.0 106.198 175.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.469 ' CZ ' HD23 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -77.39 -41.1 41.35 Favored 'General case' 0 N--CA 1.383 -3.809 0 CA-C-N 111.616 -2.538 . . . . 0.0 111.62 -167.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -69.97 96.28 1.02 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -74.13 -36.95 64.22 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.192 -0.913 . . . . 0.0 113.291 -174.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -93.08 -13.57 28.4 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.231 -177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.07 57.4 8.64 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 121.313 -0.47 . . . . 0.0 113.593 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -113.74 -11.96 12.84 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 116.913 0.356 . . . . 0.0 111.053 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.41 ' C ' ' HZ ' ' A' ' 16' ' ' PHE . . . 102.66 5.75 47.73 Favored Glycine 0 N--CA 1.43 -1.704 0 C-N-CA 119.833 -1.175 . . . . 0.0 113.118 -178.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.434 HG22 ' HA ' ' A' ' 64' ' ' ASP . 24.0 p -145.57 156.39 43.66 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 117.721 0.761 . . . . 0.0 111.011 173.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 72.5 mt -107.56 109.12 27.04 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.6 p -84.96 167.93 15.44 Favored 'General case' 0 C--N 1.288 -2.072 0 O-C-N 122.202 -0.312 . . . . 0.0 110.962 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -56.56 -34.36 67.03 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 123.304 0.642 . . . . 0.0 111.226 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -59.65 -42.15 92.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.819 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -70.25 -33.31 71.46 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.933 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.568 HD11 HG13 ' A' ' 52' ' ' ILE . 65.2 mt -56.25 -59.73 4.52 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 174.035 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.14 -26.8 64.1 Favored Glycine 0 C--O 1.19 -2.652 0 CA-C-N 114.599 -1.182 . . . . 0.0 112.968 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.4 m -65.24 -53.55 42.66 Favored 'General case' 0 CA--C 1.558 1.286 0 CA-C-N 117.734 0.767 . . . . 0.0 110.705 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.1 m -72.27 -32.56 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.32 0.581 . . . . 0.0 109.861 -178.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.421 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 66.9 mtp -72.33 -29.24 63.64 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.589 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -68.15 -36.12 79.15 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 175.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -63.43 -27.46 69.3 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.02 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.565 HD11 ' HD2' ' B' ' 91' ' ' LYS . 4.6 mm? -85.51 -13.54 48.71 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.105 0.478 . . . . 0.0 111.052 177.277 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.14 16.81 36.74 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.153 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -106.16 130.56 54.02 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -124.38 83.99 56.84 Favored Pre-proline 0 C--N 1.3 -1.545 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.965 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.559 ' HG2' HD21 ' A' ' 48' ' ' LEU . 6.2 Cg_endo -85.73 164.55 10.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.46 2.107 . . . . 0.0 111.117 173.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.0 p -86.9 169.13 12.78 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 120.932 0.396 . . . . 0.0 111.349 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -58.71 -45.58 89.24 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 125.275 1.43 . . . . 0.0 110.229 -176.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.88 95.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.512 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.435 ' O ' ' HG3' ' A' ' 51' ' ' MET . 40.0 mt-10 -61.67 -47.22 86.34 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.006 0.432 . . . . 0.0 110.128 178.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.559 HD21 ' HG2' ' A' ' 43' ' ' PRO . 95.8 mt -64.82 -38.39 90.82 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.755 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -61.1 -46.05 92.21 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.993 176.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -62.8 -39.93 95.79 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 123.37 0.419 . . . . 0.0 111.241 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.435 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 67.9 mtt -60.78 -45.76 93.11 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.024 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.568 HG13 HD11 ' A' ' 32' ' ' LEU . 23.4 mt -73.48 -36.81 49.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.77 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.403 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.6 t30 -57.9 -22.46 48.58 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 123.086 0.554 . . . . 0.0 112.346 -176.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -64.09 -32.82 74.52 Favored 'General case' 0 N--CA 1.386 -3.651 0 C-N-CA 124.261 1.024 . . . . 0.0 111.398 176.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.482 ' CG1' ' HB2' ' A' ' 71' ' ' MET . 10.9 m -107.53 -22.81 4.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-O 121.259 0.552 . . . . 0.0 110.086 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.475 ' HB2' HG22 ' A' ' 52' ' ' ILE . 42.3 t0 -73.08 116.02 13.11 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.48 -174.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.4 -16.07 38.38 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.673 177.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -88.88 -11.08 45.65 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.081 -175.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 56.32 29.79 57.29 Favored Glycine 0 CA--C 1.525 0.664 0 CA-C-N 115.479 -0.782 . . . . 0.0 113.354 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 37.2 p30 -116.33 -12.8 11.07 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 108.78 24.69 5.98 Favored Glycine 0 N--CA 1.44 -1.068 0 C-N-CA 119.489 -1.339 . . . . 0.0 113.582 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.3 p -120.24 131.6 55.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 117.581 0.691 . . . . 0.0 111.814 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.9 mt -94.67 110.21 23.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 170.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.434 ' HA ' HG22 ' A' ' 26' ' ' THR . 5.1 m-20 -90.98 158.01 16.96 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 178.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.435 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 21.9 t80 -55.8 -47.84 97.86 Favored Pre-proline 0 CA--C 1.555 1.172 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -176.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.435 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.5 Cg_endo -50.28 -44.6 37.92 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.607 2.205 . . . . 0.0 112.173 172.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -67.08 -42.3 84.88 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.752 0.421 . . . . 0.0 110.219 -179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.463 ' CE1' ' HA ' ' B' ' 100' ' ' ALA . 0.5 OUTLIER -56.51 -50.41 71.88 Favored 'General case' 0 C--O 1.244 0.79 0 C-N-CA 124.358 1.063 . . . . 0.0 109.55 176.352 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.4 mt -61.04 -40.75 94.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.764 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 2' ' ' ASP . 45.0 m -59.26 -48.01 83.22 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.566 177.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.482 ' HB2' ' CG1' ' A' ' 55' ' ' VAL . 29.9 ttp -57.89 -49.99 74.84 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.938 178.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 24.4 mmt -67.39 -43.42 81.39 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 120.252 -0.579 . . . . 0.0 112.43 -176.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 77' ' ' LYS . . . -60.48 -31.36 70.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.041 0.448 . . . . 0.0 111.216 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -80.75 -40.89 24.41 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-O 121.023 0.439 . . . . 0.0 110.871 176.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -77.99 -38.07 45.8 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.146 0.498 . . . . 0.0 110.444 -169.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 46.7 mtm -83.17 -26.94 30.43 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.048 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 73' ' ' ALA . 67.1 mttm -124.84 -82.41 0.64 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -174.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -100.34 84.06 2.74 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -170.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 93.4 m 165.41 57.87 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 129.885 3.274 . . . . 0.0 105.516 172.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 62.45 92.01 0.06 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.961 -177.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.2 t -71.45 -20.18 62.13 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.932 -172.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.412 ' H ' ' CD ' ' A' ' 82' ' ' GLU . 0.4 OUTLIER -90.72 1.98 56.38 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -64.35 -42.48 96.22 Favored 'General case' 0 CA--C 1.507 -0.691 0 C-N-CA 120.074 -0.65 . . . . 0.0 110.126 172.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -58.07 -40.11 80.22 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.887 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 44.9 mm -67.4 -44.51 86.93 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.172 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -71.7 -39.78 69.96 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.491 -178.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -64.82 -40.66 95.56 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 120.827 0.346 . . . . 0.0 110.876 177.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.466 ' HB1' HD12 ' B' ' 89' ' ' ILE . . . -68.02 -35.94 79.13 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.241 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -65.62 -48.58 71.75 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -55.42 -32.63 62.84 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 179.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 13.8 p -74.62 -28.84 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.334 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.439 ' O ' ' HG2' ' A' ' 104' ' ' GLU . 88.3 m-85 -89.19 -35.56 16.15 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.417 0.627 . . . . 0.0 110.23 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -88.82 69.31 8.63 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 174.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -66.6 -34.51 78.04 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 113.821 -1.536 . . . . 0.0 112.771 -171.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -90.22 -7.18 54.18 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.422 0.629 . . . . 0.0 110.476 -176.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.06 55.91 6.78 Favored Glycine 0 CA--C 1.502 -0.764 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -104.19 -18.59 14.44 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.973 0.416 . . . . 0.0 110.181 -175.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.9 10.56 66.58 Favored Glycine 0 N--CA 1.436 -1.36 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.036 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -156.32 141.49 17.38 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 120.851 0.357 . . . . 0.0 110.739 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.487 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.1 mt -97.49 137.02 26.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.241 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 61.9 p -114.99 158.16 22.44 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.496 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.405 ' HB1' HG23 ' A' ' 121' ' ' VAL . . . -66.45 -34.84 78.84 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 121.075 0.464 . . . . 0.0 109.879 178.121 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.89 -52.01 67.27 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.859 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.697 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 41.1 tp10 -65.61 -43.3 90.03 Favored 'General case' 0 CA--C 1.482 -1.636 0 C-N-CA 120.424 -0.51 . . . . 0.0 111.554 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.488 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.1 tt -57.38 -39.28 75.72 Favored 'General case' 0 N--CA 1.423 -1.814 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 -173.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.615 ' HG3' HG21 ' A' ' 121' ' ' VAL . 52.8 mtp180 -65.77 -34.66 78.69 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 173.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.697 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 30.7 m170 -58.98 -55.57 33.46 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.669 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -64.81 -37.74 80.95 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.392 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.732 -176.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.488 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.2 mmt -60.3 -37.94 82.12 Favored 'General case' 0 C--O 1.251 1.149 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 65.1 m -62.25 -40.58 96.67 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.18 177.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.95 -17.06 53.94 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.251 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.669 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 97.2 mt -92.18 -14.1 29.59 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 121.2 0.524 . . . . 0.0 111.83 -176.094 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 82.2 6.1 89.08 Favored Glycine 0 N--CA 1.437 -1.274 0 C-N-CA 120.272 -0.966 . . . . 0.0 111.418 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.41 ' HB2' ' SD ' ' A' ' 109' ' ' MET . 47.2 mm-40 -73.2 -44.08 60.33 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 67.1 mttm 57.58 90.74 0.04 OUTLIER 'General case' 0 C--O 1.242 0.668 0 O-C-N 124.763 1.29 . . . . 0.0 111.026 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.427 HD22 ' HG2' ' A' ' 120' ' ' GLU . 76.4 mt -125.89 131.28 52.38 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 -178.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 17.5 p -83.05 176.89 8.88 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.638 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -60.22 -27.74 67.44 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -172.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -68.75 -51.3 42.67 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 118.825 0.739 . . . . 0.0 111.011 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.427 ' HG2' HD22 ' A' ' 116' ' ' LEU . 7.2 tp10 -58.19 -49.78 75.83 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.945 -177.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.615 HG21 ' HG3' ' A' ' 106' ' ' ARG . 4.3 m -69.99 -29.03 38.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.845 -176.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -65.08 -46.95 79.02 Favored 'General case' 0 CA--C 1.485 -1.52 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -63.17 -36.73 84.59 Favored 'General case' 0 N--CA 1.443 -0.79 0 O-C-N 124.157 0.911 . . . . 0.0 109.79 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.9 mtt -59.88 -49.83 76.16 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.14 176.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 47.3 mm -69.03 -54.0 22.7 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.47 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.29 -178.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -57.15 -41.2 78.69 Favored 'General case' 0 C--N 1.309 -1.167 0 C-N-CA 124.806 1.242 . . . . 0.0 112.802 -172.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -81.87 -21.82 37.25 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.925 -0.71 . . . . 0.0 111.698 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -80.08 -36.45 35.5 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 176.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -61.83 104.44 0.45 Allowed 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 125.707 1.603 . . . . 0.0 109.221 175.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 72.1 mt -83.28 -45.25 18.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.65 -175.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -82.26 -11.01 58.91 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.879 -0.601 . . . . 0.0 112.29 -170.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.18 53.95 3.73 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.718 177.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -115.68 -17.59 11.06 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 121.566 0.698 . . . . 0.0 110.435 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.86 9.85 62.07 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -144.95 125.97 14.53 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.487 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.0 OUTLIER -90.56 117.9 34.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 123.455 0.472 . . . . 0.0 111.702 -178.362 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -84.79 175.66 9.01 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.5 178.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.541 ' O ' HG13 ' A' ' 142' ' ' VAL . 84.2 t80 -62.3 -43.26 99.24 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.709 -177.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -63.77 -21.99 66.69 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -87.78 -35.62 17.76 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -72.98 -36.66 67.13 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.72 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.541 HG13 ' O ' ' A' ' 138' ' ' TYR . 33.8 m -59.48 -35.44 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-O 120.995 0.426 . . . . 0.0 111.7 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -70.51 -29.62 66.18 Favored 'General case' 0 C--O 1.205 -1.241 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.977 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 73.2 mtp -57.78 -40.38 79.71 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.794 0.438 . . . . 0.0 112.09 -177.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 51.8 tpp -74.04 -29.46 61.92 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.22 0.533 . . . . 0.0 110.555 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 8.2 m -80.72 -23.48 39.46 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.777 0.798 . . . . 0.0 108.978 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -109.62 33.27 4.45 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.419 -177.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.4 tttm . . . . . 0 C--N 1.288 -2.104 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 -179.32 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 17.6 m . . . . . 0 N--CA 1.442 -0.86 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.05 119.29 5.01 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.626 2.217 . . . . 0.0 112.171 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -78.87 -74.77 0.26 Allowed 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 175.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -146.71 17.29 1.28 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 174.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -75.67 -20.63 58.3 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 112.618 -2.083 . . . . 0.0 109.949 -176.074 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -121.33 125.26 46.57 Favored 'General case' 0 N--CA 1.411 -2.4 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -178.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -108.99 19.85 19.1 Favored 'General case' 0 C--N 1.281 -2.411 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -41.27 -52.16 3.46 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 127.732 2.413 . . . . 0.0 112.897 -177.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -67.75 -38.21 83.16 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.644 -174.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -82.42 -37.22 25.81 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.96 -47.55 85.91 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.728 0.642 . . . . 0.0 109.679 176.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.643 ' O ' HG12 ' B' ' 89' ' ' ILE . 38.8 m95 -63.71 -43.12 97.53 Favored 'General case' 0 C--O 1.199 -1.573 0 CA-C-O 119.415 -0.326 . . . . 0.0 111.486 175.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -53.09 -51.75 60.82 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.87 0.843 . . . . 0.0 109.191 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -58.24 -45.66 87.35 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 113.43 -1.714 . . . . 0.0 109.595 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.25 -49.4 75.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.13 178.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.643 HG12 ' O ' ' B' ' 85' ' ' TRP . 51.8 mm -57.71 -51.44 70.17 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.468 0 C-N-CA 123.347 0.659 . . . . 0.0 109.312 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -61.8 -28.94 69.82 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.239 -177.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.565 ' HD2' HD11 ' A' ' 39' ' ' LEU . 4.5 tppp? -81.71 -53.29 6.34 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 120.983 0.421 . . . . 0.0 110.975 175.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.93 -44.89 68.69 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -174.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -79.84 4.55 16.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.801 0.81 . . . . 0.0 110.222 -175.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 94' ' ' HIS . . . . . 0.438 ' CG ' ' HA ' ' B' ' 99' ' ' TRP . 25.1 m170 -116.92 19.21 14.47 Favored 'General case' 0 CA--C 1.489 -1.392 0 O-C-N 121.814 -0.553 . . . . 0.0 111.831 178.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.47 ' HB2' ' HD3' ' B' ' 96' ' ' PRO . 67.5 mtm -75.01 -52.4 3.25 Favored Pre-proline 0 N--CA 1.435 -1.209 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.922 172.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.47 ' HD3' ' HB2' ' B' ' 95' ' ' MET . 23.6 Cg_endo -101.66 13.88 0.38 Allowed 'Trans proline' 0 C--N 1.383 2.347 0 C-N-CA 121.844 1.696 . . . . 0.0 112.29 177.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -138.62 128.85 14.97 Favored Pre-proline 0 C--N 1.315 -0.928 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 -175.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -46.97 117.68 2.31 Favored 'Trans proline' 0 C--O 1.244 0.818 0 C-N-CA 123.594 2.863 . . . . 0.0 113.622 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 99' ' ' TRP . . . . . 0.438 ' HA ' ' CG ' ' B' ' 94' ' ' HIS . 2.0 t90 -64.97 -32.64 74.47 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.161 175.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 100' ' ' ALA . . . . . 0.463 ' HA ' ' CE1' ' A' ' 68' ' ' PHE . . . . . . . . 0 N--CA 1.389 -3.491 0 N-CA-C 103.776 -2.676 . . . . 0.0 103.776 -178.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.395 0 N-CA-C 110.984 -0.006 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 72.59 -68.91 0.21 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 125.3 1.44 . . . . 0.0 112.371 173.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.489 ' HA ' ' OE1' ' A' ' 3' ' ' GLN . 10.7 mm-40 54.76 74.88 0.33 Allowed 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 126.109 1.764 . . . . 0.0 113.514 -177.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.448 ' HB3' HD11 ' A' ' 9' ' ' ILE . 14.4 tp -110.88 138.91 46.7 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.41 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 10.0 p -68.15 142.87 55.61 Favored 'General case' 0 N--CA 1.424 -1.726 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.632 178.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -59.18 -33.29 70.77 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 123.936 0.894 . . . . 0.0 112.481 -171.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 34.2 tt0 -66.38 -41.5 89.32 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.23 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.41 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 12.3 mm100 -67.69 -40.66 84.35 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.576 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 63.5 mt -58.12 -41.38 80.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.926 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.49 95.53 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 121.51 0.671 . . . . 0.0 110.921 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 7' ' ' GLU . 30.3 mt-10 -69.89 -30.96 68.52 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.727 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -75.71 -23.77 56.13 Favored 'General case' 0 C--O 1.189 -2.1 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.979 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.576 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -63.38 -46.75 85.03 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 120.838 0.351 . . . . 0.0 110.762 176.229 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -68.34 -40.06 81.71 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.132 -0.627 . . . . 0.0 111.529 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.04 -38.91 89.56 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-O 121.226 0.536 . . . . 0.0 109.803 178.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -60.06 -46.57 89.1 Favored 'General case' 0 C--O 1.2 -1.548 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.982 176.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.1 m -69.36 -17.2 63.66 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.374 -178.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.72 -33.48 64.38 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 176.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.553 ' CD2' HG21 ' A' ' 35' ' ' VAL . 20.4 m-85 -89.86 -38.61 13.62 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.821 178.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -80.79 97.93 7.56 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 176.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -75.1 -6.92 52.08 Favored 'General case' 0 C--N 1.288 -2.076 0 CA-C-N 115.265 -0.879 . . . . 0.0 113.223 -176.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.428 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 18.9 m-20 -102.67 -14.53 16.66 Favored 'General case' 0 C--O 1.244 0.778 0 C-N-CA 119.379 -0.928 . . . . 0.0 109.38 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.78 45.92 94.21 Favored Glycine 0 C--N 1.339 0.722 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -175.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.428 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 2.7 p30 -113.3 -16.24 12.54 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -173.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.23 4.79 50.25 Favored Glycine 0 C--N 1.309 -0.935 0 C-N-CA 121.149 -0.548 . . . . 0.0 113.355 178.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 79.9 p -132.92 139.32 47.29 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 117.458 0.629 . . . . 0.0 109.63 173.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.9 mt -112.04 129.82 66.82 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.8 p -99.28 174.58 6.23 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.908 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.4 p -66.18 -31.25 71.97 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 121.611 0.72 . . . . 0.0 109.866 176.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -61.56 -50.62 71.91 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.439 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.32 -42.91 92.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.817 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.0 mt -56.78 -53.37 58.56 Favored 'General case' 0 C--O 1.22 -0.452 0 O-C-N 123.573 0.546 . . . . 0.0 111.273 177.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.74 -37.43 94.35 Favored Glycine 0 C--O 1.226 -0.364 0 C-N-CA 120.201 -0.999 . . . . 0.0 112.837 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 70.3 m -62.69 -46.19 89.27 Favored 'General case' 0 C--O 1.25 1.114 0 CA-C-N 116.948 0.374 . . . . 0.0 111.339 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.553 HG21 ' CD2' ' A' ' 19' ' ' PHE . 32.9 m -71.17 -34.05 53.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 C-N-CA 120.164 -0.614 . . . . 0.0 110.56 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.645 ' HB3' ' O ' ' A' ' 41' ' ' GLN . 62.1 mtt -66.99 -36.04 81.28 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.418 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -62.34 -41.31 98.47 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.288 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.9 m -67.68 -27.4 66.81 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.998 176.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 97.4 mt -82.47 -10.5 59.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.803 0.335 . . . . 0.0 111.125 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.83 24.65 48.6 Favored Glycine 0 N--CA 1.439 -1.148 0 C-N-CA 121.169 -0.539 . . . . 0.0 112.815 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.645 ' O ' ' HB3' ' A' ' 36' ' ' MET . 48.5 tt0 -155.23 100.26 2.14 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -122.26 92.59 48.89 Favored Pre-proline 0 C--N 1.304 -1.402 0 C-N-CA 119.265 -0.974 . . . . 0.0 113.443 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.557 ' HD2' ' SD ' ' A' ' 36' ' ' MET . 50.2 Cg_exo -56.8 161.62 9.97 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 123.404 2.736 . . . . 0.0 111.695 171.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.484 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 19.1 p -74.6 160.25 31.1 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -176.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -51.9 -44.45 63.8 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 124.175 0.99 . . . . 0.0 112.613 -177.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.69 76.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.062 0.458 . . . . 0.0 110.962 -178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 51' ' ' MET . 39.9 mm-40 -72.78 -42.75 63.61 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.45 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 44' ' ' THR . 79.2 mt -62.63 -39.53 94.14 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.549 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.9 tp60 -67.22 -35.15 78.99 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.732 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.19 -39.17 78.84 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 123.285 0.366 . . . . 0.0 110.128 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.563 ' SD ' ' HA ' ' B' ' 97' ' ' ASP . 61.5 mtt -57.09 -47.31 81.34 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.027 174.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.9 mt -59.45 -50.35 80.24 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.247 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.445 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 12.1 t30 -63.04 -15.69 57.34 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -173.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -71.16 -39.24 72.05 Favored 'General case' 0 N--CA 1.384 -3.732 0 O-C-N 121.759 -0.588 . . . . 0.0 110.275 175.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.409 HG11 ' SD ' ' A' ' 71' ' ' MET . 26.0 m -99.57 -20.69 5.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.307 -177.172 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.445 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 46.7 t0 -68.04 99.3 0.85 Allowed 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.258 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.45 -29.68 22.63 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.799 -173.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -91.03 -9.79 44.56 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.967 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.94 46.77 70.49 Favored Glycine 0 N--CA 1.441 -0.987 0 CA-C-N 115.399 -0.819 . . . . 0.0 113.255 174.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -101.91 -9.43 20.7 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.308 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.84 -6.3 43.89 Favored Glycine 0 N--CA 1.44 -1.053 0 C-N-CA 120.537 -0.839 . . . . 0.0 113.596 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.8 p -130.01 161.71 30.34 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-N 117.489 0.645 . . . . 0.0 110.991 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 26' ' ' THR . 29.1 mt -99.05 119.37 46.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.435 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.576 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 7.4 t0 -89.27 161.72 16.24 Favored 'General case' 0 C--N 1.292 -1.922 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.296 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.407 ' CZ ' HD21 ' A' ' 69' ' ' LEU . 54.7 t80 -53.53 -53.58 55.28 Favored Pre-proline 0 CA--C 1.569 1.702 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -176.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.576 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 8.7 Cg_endo -50.76 -38.45 56.65 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 123.224 2.616 . . . . 0.0 113.603 174.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -69.62 -37.43 76.83 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.796 0.808 . . . . 0.0 109.688 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -67.63 -39.07 84.66 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.327 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.407 HD21 ' CZ ' ' A' ' 65' ' ' PHE . 78.2 mt -62.68 -39.72 94.87 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.492 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.7 m -56.07 -48.34 76.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.301 0.572 . . . . 0.0 109.634 176.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.525 ' HE3' ' HB2' ' B' ' 98' ' ' PRO . 28.3 ttp -60.67 -42.47 97.15 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.596 179.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.404 ' O ' ' HB3' ' A' ' 75' ' ' LYS . 20.9 mmt -73.98 -36.18 64.53 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.26 -41.05 97.12 Favored 'General case' 0 C--O 1.21 -1.005 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 175.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -63.06 -30.03 71.28 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.346 175.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 72' ' ' MET . 37.3 ttmt -63.78 -41.03 98.03 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 121.151 0.5 . . . . 0.0 109.934 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.5 mtm -102.23 13.42 34.71 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.564 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -131.36 -73.97 0.53 Allowed 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.354 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -91.17 61.11 4.44 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 122.214 1.007 . . . . 0.0 110.594 -176.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 69.6 m -158.86 129.06 5.86 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 104.818 -2.29 . . . . 0.0 104.818 176.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.83 -31.85 73.05 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.297 0.57 . . . . 0.0 109.545 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.558 ' O ' HG12 ' A' ' 85' ' ' ILE . 37.2 m 83.58 -10.3 0.97 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 168.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -57.05 -44.76 83.32 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.637 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 2.2 mp0 -46.87 -57.31 5.06 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 125.757 1.623 . . . . 0.0 110.348 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.59 -45.87 70.86 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.421 -175.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.558 HG12 ' O ' ' A' ' 81' ' ' SER . 19.8 mm -73.67 -35.7 44.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 120.704 0.287 . . . . 0.0 111.393 -174.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -74.68 -32.42 62.2 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -62.04 -45.45 93.51 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 176.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.401 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -67.02 -38.66 86.34 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 113.964 -1.471 . . . . 0.0 111.261 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -66.4 -41.67 88.98 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -53.87 -40.46 66.56 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 111.284 177.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 88' ' ' ALA . 11.6 p -75.58 -29.2 20.5 Favored 'Isoleucine or valine' 0 C--O 1.246 0.911 0 CA-C-O 120.917 0.389 . . . . 0.0 111.188 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -77.32 -62.71 1.57 Allowed 'General case' 0 C--O 1.21 -1.008 0 C-N-CA 119.689 -0.805 . . . . 0.0 111.084 178.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -85.84 94.75 9.23 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.764 0.792 . . . . 0.0 111.704 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.49 ' HZ1' ' HB ' ' A' ' 108' ' ' VAL . 43.0 mttp -80.44 -17.47 51.64 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 114.912 -1.04 . . . . 0.0 113.367 -178.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -92.65 -12.23 32.12 Favored 'General case' 0 CA--C 1.499 -0.994 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -176.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.95 44.54 30.08 Favored Glycine 0 N--CA 1.444 -0.785 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -93.43 -18.48 22.29 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.0 17.32 74.91 Favored Glycine 0 C--O 1.241 0.537 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.539 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 79.3 m-85 -150.0 152.61 35.18 Favored 'General case' 0 N--CA 1.437 -1.1 0 C-N-CA 124.617 1.167 . . . . 0.0 108.437 -177.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.491 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.3 mt -109.61 131.67 59.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.303 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 174.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.5 p -110.32 156.33 20.88 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.19 -41.58 97.07 Favored 'General case' 0 C--O 1.212 -0.882 0 C-N-CA 122.685 0.394 . . . . 0.0 111.504 -178.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.62 -49.14 78.9 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 123.16 0.287 . . . . 0.0 111.035 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -56.44 -52.41 64.78 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.899 0.857 . . . . 0.0 109.7 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.487 ' O ' ' HG2' ' A' ' 109' ' ' MET . 8.0 tt -63.54 -40.52 97.21 Favored 'General case' 0 N--CA 1.413 -2.306 0 CA-C-N 113.941 -1.482 . . . . 0.0 110.192 -172.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -61.11 -43.1 99.4 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -68.98 -37.52 78.8 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.002 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.59 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.1 p -66.32 -29.89 48.09 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.265 0 C-N-CA 119.497 -0.881 . . . . 0.0 109.623 177.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.487 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.4 mmt -60.52 -40.11 90.26 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-O 120.646 0.26 . . . . 0.0 110.593 176.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.3 m -60.83 -40.23 92.0 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.936 175.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -75.4 -17.27 60.24 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.808 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 68.4 mt -98.93 -20.61 16.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.994 0.426 . . . . 0.0 110.857 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.41 11.62 47.56 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.642 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -89.18 137.11 32.62 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -177.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -118.21 90.98 3.45 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-O 121.495 0.664 . . . . 0.0 110.258 177.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 75.9 mt -110.95 167.0 10.58 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 28.7 p -100.7 172.54 7.02 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.8 -24.94 67.96 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -67.87 -40.1 83.63 Favored 'General case' 0 N--CA 1.428 -1.547 0 C-N-CA 123.046 0.538 . . . . 0.0 110.784 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -75.49 -42.94 51.6 Favored 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 121.811 -0.556 . . . . 0.0 111.996 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 125' ' ' ILE . 14.1 m -68.39 -29.58 44.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 C-N-CA 120.285 -0.566 . . . . 0.0 109.913 -178.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -70.67 -43.67 68.64 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.324 176.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -64.2 -35.11 79.72 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.469 ' HE3' ' HB1' ' B' ' 84' ' ' ALA . 62.8 mtt -54.15 -51.26 64.85 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.151 175.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.5 mm -69.11 -59.72 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.226 -177.046 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -61.82 -33.53 74.3 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 -170.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.493 ' HB3' ' CE1' ' B' ' 81' ' ' PHE . 14.9 tp10 -81.08 -24.39 37.81 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 119.985 -0.686 . . . . 0.0 110.673 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.705 ' HA ' ' SD ' ' A' ' 144' ' ' MET . . . -91.93 -12.85 32.31 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 122.375 1.083 . . . . 0.0 109.768 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -78.82 72.77 5.36 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 122.819 1.295 . . . . 0.0 110.286 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.414 ' HB ' ' OE1' ' A' ' 140' ' ' GLU . 35.7 mt -82.79 -12.26 12.13 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 CA-C-N 114.291 -1.322 . . . . 0.0 107.938 174.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -79.92 -10.42 59.77 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.81 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.64 40.62 99.39 Favored Glycine 0 N--CA 1.442 -0.964 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.744 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -112.34 -16.42 12.95 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.319 0.581 . . . . 0.0 110.142 -177.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 90.99 14.32 57.91 Favored Glycine 0 C--O 1.25 1.147 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 -177.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.539 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 26.0 mt-30 -150.11 139.49 21.4 Favored 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 124.699 1.2 . . . . 0.0 107.791 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.491 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.2 p -76.23 123.99 33.54 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.139 0.495 . . . . 0.0 110.977 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -91.71 154.08 19.22 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.546 ' O ' HG13 ' A' ' 142' ' ' VAL . 82.8 t80 -57.95 -48.99 78.32 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 124.328 1.051 . . . . 0.0 110.151 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -66.71 -22.14 66.07 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.414 ' OE1' ' HB ' ' A' ' 130' ' ' ILE . 29.0 mm-40 -87.32 -37.52 17.06 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -69.21 -35.03 75.78 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.295 -178.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.546 HG13 ' O ' ' A' ' 138' ' ' TYR . 22.2 m -65.19 -31.31 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 121.173 0.511 . . . . 0.0 110.066 177.135 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -70.83 -48.55 53.43 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.705 ' SD ' ' HA ' ' A' ' 128' ' ' ALA . 82.7 mtp -66.59 -15.82 63.72 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.328 -178.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 57.3 tpp -78.76 -41.74 29.88 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-O 120.818 0.342 . . . . 0.0 110.199 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 11.9 t -84.18 -27.89 27.74 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.724 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -84.15 109.62 17.87 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.7 tptp . . . . . 0 C--N 1.294 -1.821 0 CA-C-O 118.647 -0.692 . . . . 0.0 109.155 -178.163 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 36.5 m . . . . . 0 N--CA 1.441 -0.902 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -54.7 -36.47 90.16 Favored 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 123.035 2.49 . . . . 0.0 113.413 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.03 135.41 48.9 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 120.727 0.298 . . . . 0.0 110.671 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -148.85 176.08 10.71 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 96.5 p -83.77 -21.13 32.29 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 173.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 36.9 t80 73.37 9.72 5.1 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.455 1.902 . . . . 0.0 110.488 177.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 47.5 m170 -73.25 -18.18 61.25 Favored 'General case' 0 C--O 1.215 -0.719 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 178.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' PHE . . . . . 0.493 ' CE1' ' HB3' ' A' ' 127' ' ' GLU . 72.6 t80 -42.18 -41.9 2.83 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 126.855 2.062 . . . . 0.0 111.516 174.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 82' ' ' LYS . . . . . 0.545 ' O ' ' HB2' ' B' ' 86' ' ' LYS . 64.1 tttp -61.6 -52.09 65.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.14 -177.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -76.82 -27.64 55.24 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-O 121.104 0.478 . . . . 0.0 110.595 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.469 ' HB1' ' HE3' ' A' ' 124' ' ' MET . . . -62.61 -61.35 2.49 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.582 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.548 ' O ' HG12 ' B' ' 89' ' ' ILE . 57.2 m95 -64.62 -31.05 72.1 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 86' ' ' LYS . . . . . 0.545 ' HB2' ' O ' ' B' ' 82' ' ' LYS . 78.8 tttt -52.98 -50.02 64.99 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 124.454 1.102 . . . . 0.0 109.866 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -76.38 -41.17 48.92 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.461 177.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 88' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' B' ' 85' ' ' TRP . . . -55.13 -59.8 4.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -177.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.548 HG12 ' O ' ' B' ' 85' ' ' TRP . 32.1 pt -68.56 -27.94 38.33 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.707 0 C-N-CA 120.389 -0.524 . . . . 0.0 111.216 -178.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 90' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' B' ' 86' ' ' LYS . 53.8 tt0 -62.81 -61.76 2.19 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -65.31 -35.19 80.24 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.285 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.02 -33.24 65.62 Favored 'General case' 0 C--O 1.247 0.926 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 25.0 tptp -63.8 -53.09 56.31 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 52.5 85.49 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.727 0 O-C-N 124.417 1.073 . . . . 0.0 110.442 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 37.1 ttm -121.07 147.82 47.49 Favored Pre-proline 0 C--N 1.298 -1.673 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.429 -172.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -80.47 -152.76 0.04 OUTLIER 'Trans proline' 0 CA--C 1.547 1.131 0 C-N-CA 122.416 2.077 . . . . 0.0 108.346 167.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 97' ' ' ASP . . . . . 0.563 ' HA ' ' SD ' ' A' ' 51' ' ' MET . 22.8 m-20 66.78 -178.97 0.04 OUTLIER Pre-proline 0 N--CA 1.488 1.471 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 -179.113 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 98' ' ' PRO . . . . . 0.525 ' HB2' ' HE3' ' A' ' 71' ' ' MET . 2.2 Cg_endo -83.05 76.58 3.95 Favored 'Trans proline' 0 N--CA 1.443 -1.485 0 CA-C-N 121.097 1.428 . . . . 0.0 108.576 173.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 21.1 t90 -85.62 135.8 33.64 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 113.744 -1.571 . . . . 0.0 114.716 -171.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.604 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 169.176 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.371 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.6 t70 68.66 -61.07 0.42 Allowed 'General case' 0 N--CA 1.499 1.976 0 C-N-CA 125.574 1.55 . . . . 0.0 112.829 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.466 ' HA ' ' OE1' ' A' ' 3' ' ' GLN . 15.9 mm-40 -92.18 119.11 31.51 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.122 0.487 . . . . 0.0 109.813 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 12' ' ' PHE . 10.2 tp -92.67 142.06 27.78 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.826 -174.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 21.2 p -80.81 155.95 26.38 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.816 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -57.45 -44.23 84.61 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -173.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -69.18 -34.05 74.33 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.57 -177.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -63.55 -44.14 95.01 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.495 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 29.6 mt -61.61 -33.25 56.46 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.103 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.541 179.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.13 -46.17 85.3 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-O 121.019 0.437 . . . . 0.0 110.454 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.32 -48.94 75.69 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.406 -0.815 . . . . 0.0 108.986 175.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 56.6 m-85 -71.41 -16.6 62.4 Favored 'General case' 0 C--O 1.187 -2.187 0 CA-C-N 115.324 -0.853 . . . . 0.0 113.148 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 96.0 mttt -69.12 -43.83 73.63 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-O 121.539 0.685 . . . . 0.0 109.279 173.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -71.49 -41.13 69.69 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.644 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.43 -27.96 65.72 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.332 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.435 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 26.2 t80 -64.88 -52.74 54.89 Favored 'General case' 0 C--O 1.198 -1.623 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -71.84 -16.76 62.17 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 123.389 0.431 . . . . 0.0 110.836 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.4 tp -65.72 -36.55 83.93 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 174.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.412 ' CE2' HG21 ' A' ' 35' ' ' VAL . 6.5 m-85 -89.4 -41.86 11.86 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.619 175.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -80.65 81.94 6.78 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-O 122.582 1.182 . . . . 0.0 109.588 176.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -75.96 -19.61 58.6 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 114.287 -1.324 . . . . 0.0 112.861 -173.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.605 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 24.7 m-20 -78.15 -14.46 59.46 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.218 178.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.18 33.37 85.01 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.605 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 6.3 p-10 -112.97 -16.24 12.71 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.939 0.399 . . . . 0.0 110.793 -176.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.28 26.33 14.25 Favored Glycine 0 N--CA 1.441 -1.002 0 N-CA-C 115.635 1.014 . . . . 0.0 115.635 176.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.3 p -141.68 130.53 23.0 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 118.233 1.017 . . . . 0.0 109.096 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 61.2 mt -91.97 115.97 32.12 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.172 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.2 p -96.21 166.78 11.57 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 123.807 0.692 . . . . 0.0 109.944 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 36.4 p -64.27 -27.34 68.97 Favored 'General case' 0 C--O 1.249 1.075 0 CA-C-O 121.216 0.532 . . . . 0.0 110.087 177.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -54.59 -56.85 14.71 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 114.971 -1.013 . . . . 0.0 108.911 174.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.67 -40.13 92.08 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.167 -1.379 . . . . 0.0 111.122 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.421 ' HB3' HD22 ' A' ' 48' ' ' LEU . 91.5 mt -56.53 -60.26 3.8 Favored 'General case' 0 C--O 1.212 -0.898 0 O-C-N 123.58 0.55 . . . . 0.0 110.49 175.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.6 -30.39 72.0 Favored Glycine 0 C--O 1.216 -1.02 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.773 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.6 m -68.98 -49.72 55.38 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.716 0.258 . . . . 0.0 110.915 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.577 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 27.1 m -66.91 -39.18 82.93 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.1 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -58.52 -45.48 88.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.532 0.52 . . . . 0.0 110.261 175.226 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -62.83 -35.41 79.84 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 123.255 0.622 . . . . 0.0 109.951 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 m -76.34 -12.93 60.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.814 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 97.4 mt -96.9 -17.68 19.99 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.169 177.185 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.8 32.11 9.47 Favored Glycine 0 C--N 1.311 -0.818 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -129.49 133.34 47.23 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -129.94 81.64 68.49 Favored Pre-proline 0 C--N 1.305 -1.363 0 O-C-N 121.034 -1.041 . . . . 0.0 113.596 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -78.68 155.56 27.47 Favored 'Trans proline' 0 C--O 1.247 0.951 0 C-N-CA 122.13 1.887 . . . . 0.0 109.994 171.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.459 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 70.4 p -84.1 167.21 17.0 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.793 0.33 . . . . 0.0 111.757 -177.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -55.78 -45.73 78.09 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.506 1.122 . . . . 0.0 112.077 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.79 -41.98 92.38 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 120.766 0.317 . . . . 0.0 110.942 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -63.92 -48.33 77.02 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.476 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.492 ' HA ' ' HE3' ' A' ' 51' ' ' MET . 91.1 mt -59.0 -42.65 90.59 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.231 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -69.78 -41.84 74.59 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -66.33 -35.92 81.6 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.436 0.636 . . . . 0.0 109.765 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.531 ' CG ' ' HD3' ' B' ' 98' ' ' PRO . 38.7 ttm -57.35 -39.97 77.05 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.593 1.557 . . . . 0.0 110.159 177.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 59.3 mt -74.27 -49.6 31.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.499 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.17 -31.0 62.99 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.383 -0.826 . . . . 0.0 113.02 -172.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -70.64 -11.36 60.89 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.504 HG11 ' SD ' ' A' ' 71' ' ' MET . 28.4 m -119.89 -18.19 6.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 O-C-N 122.403 -0.186 . . . . 0.0 110.863 174.085 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -70.13 107.72 3.8 Favored 'General case' 0 N--CA 1.444 -0.772 0 O-C-N 123.777 0.673 . . . . 0.0 111.076 -176.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.86 -9.86 54.77 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.602 -176.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.58 -11.63 20.82 Favored 'General case' 0 CA--C 1.493 -1.244 0 C-N-CA 119.964 -0.694 . . . . 0.0 110.503 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.63 41.95 99.07 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 -174.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.9 p-10 -114.3 -11.23 12.6 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.187 0.518 . . . . 0.0 110.867 -176.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.29 15.6 55.22 Favored Glycine 0 N--CA 1.431 -1.635 0 C-N-CA 120.82 -0.705 . . . . 0.0 114.418 173.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 11.9 p -137.52 147.11 44.93 Favored 'General case' 0 C--O 1.248 1.022 0 CA-C-N 117.812 0.806 . . . . 0.0 111.628 177.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.594 HG21 ' HE2' ' A' ' 71' ' ' MET . 15.6 mt -99.68 110.53 27.05 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -84.58 -179.55 7.17 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.421 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 44.7 t80 -58.76 -53.93 61.36 Favored Pre-proline 0 C--N 1.311 -1.098 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -175.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.2 Cg_endo -52.98 -41.91 68.1 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.901 2.401 . . . . 0.0 111.757 176.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -67.25 -44.74 78.67 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.022 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.582 ' O ' ' HG2' ' A' ' 72' ' ' MET . 86.6 t80 -60.12 -41.82 93.45 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.049 0.539 . . . . 0.0 109.846 177.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.415 HD11 ' CE2' ' A' ' 65' ' ' PHE . 92.9 mt -65.09 -55.55 18.11 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.353 177.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 94.8 m -55.94 -41.43 74.63 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.417 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.594 ' HE2' HG21 ' A' ' 63' ' ' ILE . 20.0 ttp -55.65 -47.03 77.33 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.629 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.598 ' SD ' ' HA ' ' B' ' 99' ' ' TRP . 10.5 mmt -71.73 -41.31 68.66 Favored 'General case' 0 CA--C 1.486 -1.494 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.769 -176.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.5 -27.89 69.28 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.542 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -83.55 -30.59 26.94 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.453 0.644 . . . . 0.0 110.776 175.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -85.31 -3.29 58.78 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.895 0.855 . . . . 0.0 110.272 -173.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.522 ' HG3' ' O ' ' A' ' 72' ' ' MET . 61.7 mtt -77.5 91.77 3.96 Favored 'General case' 0 N--CA 1.429 -1.475 0 CA-C-O 121.947 0.88 . . . . 0.0 110.053 175.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -92.65 16.65 11.71 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.39 119.01 6.66 Favored 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.756 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.4 t -150.24 131.59 14.63 Favored 'General case' 0 N--CA 1.408 -2.572 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 175.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.5 t70 69.5 131.28 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.267 1.027 . . . . 0.0 111.753 -175.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.3 m -69.62 -22.0 63.52 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -173.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -102.89 -13.43 16.95 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.069 0.462 . . . . 0.0 111.049 -176.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -63.84 -33.52 75.88 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.938 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 34.3 tt0 -65.3 -31.1 72.07 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 122.106 0.955 . . . . 0.0 109.494 178.219 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.7 mm -81.42 -29.09 10.57 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 -175.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -78.73 -26.25 44.68 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.617 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.456 ' HB3' ' O ' ' A' ' 84' ' ' GLU . 41.2 tt0 -62.67 -54.87 32.88 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 172.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.45 -39.74 76.95 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 113.741 -1.572 . . . . 0.0 110.617 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -62.49 -46.32 88.97 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.49 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 78.5 mtm180 -68.02 -25.09 65.21 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -178.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.416 HG11 ' HB1' ' B' ' 92' ' ' ALA . 14.0 p -82.79 -19.72 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 120.196 -0.601 . . . . 0.0 110.633 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -91.84 -56.84 2.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -84.98 83.99 7.87 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 122.09 0.948 . . . . 0.0 109.155 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -78.84 -35.17 44.37 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.642 -177.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -72.16 -14.32 61.79 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.516 0.674 . . . . 0.0 110.581 -178.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.62 54.09 10.95 Favored Glycine 0 N--CA 1.431 -1.685 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.288 175.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -89.21 -18.56 26.85 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 121.02 0.438 . . . . 0.0 110.13 176.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.18 13.0 75.17 Favored Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -178.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.434 ' HB3' ' HG2' ' A' ' 135' ' ' GLN . 76.4 m-85 -149.7 143.21 25.32 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.552 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.8 mt -87.84 109.68 19.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.8 m -80.18 140.04 36.51 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.42 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -59.47 -39.45 83.75 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 122.48 0.312 . . . . 0.0 111.416 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.81 -50.18 74.49 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.303 0.377 . . . . 0.0 111.497 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -70.51 -38.21 74.25 Favored 'General case' 0 CA--C 1.506 -0.749 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.787 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.484 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.5 tm? -59.58 -43.89 93.5 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.497 ' HA ' HG11 ' A' ' 121' ' ' VAL . 39.2 ttt180 -61.62 -45.13 95.4 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.536 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.5 m170 -59.87 -49.4 77.85 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.671 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.583 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -64.88 -33.36 63.03 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.385 0 C-N-CA 120.134 -0.626 . . . . 0.0 110.573 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.484 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.1 mmt -61.23 -41.94 97.75 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 120.887 0.375 . . . . 0.0 111.534 179.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 61.3 m -61.0 -38.51 86.29 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.217 176.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -76.73 -22.59 53.64 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.073 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 95.1 mt -88.95 -19.71 25.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.201 0.524 . . . . 0.0 110.541 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.36 0.55 55.71 Favored Glycine 0 N--CA 1.436 -1.336 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.162 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -70.62 -38.15 73.9 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.8 mttm 59.24 33.27 22.55 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.32 174.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.438 HD22 ' HG2' ' A' ' 120' ' ' GLU . 60.2 mt -64.52 138.25 58.3 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.621 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 36.8 p -76.91 174.42 10.6 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.857 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -63.35 -44.32 95.15 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 116.9 -0.136 . . . . 0.0 111.263 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.506 ' CD ' ' H ' ' A' ' 119' ' ' GLU . 1.4 mp0 -59.52 -37.6 78.76 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.438 ' HG2' HD22 ' A' ' 116' ' ' LEU . 8.1 tp10 -66.78 -55.77 13.45 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.464 -178.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.499 ' O ' HG12 ' A' ' 125' ' ' ILE . 11.4 m -64.21 -32.55 57.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.032 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -60.88 -45.74 93.39 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.688 0.795 . . . . 0.0 110.295 175.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -65.18 -43.32 92.06 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.184 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.527 ' HA ' ' CE2' ' B' ' 81' ' ' PHE . 54.1 mtt -56.54 -37.27 70.27 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.301 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.9 mm -76.22 -58.27 4.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.258 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -50.97 -44.83 60.76 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.935 1.294 . . . . 0.0 113.957 -173.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.558 ' HB3' ' CZ ' ' B' ' 81' ' ' PHE . 5.3 tp10 -83.54 -13.61 54.11 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 119.65 -0.82 . . . . 0.0 111.081 -174.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -96.76 -22.3 17.04 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.505 0.669 . . . . 0.0 109.582 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -72.7 92.53 1.56 Allowed 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.546 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.412 ' HB ' ' HG3' ' A' ' 140' ' ' GLU . 57.0 mt -82.41 -19.59 10.4 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.668 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.841 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -89.22 -12.06 41.88 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-O 121.408 0.623 . . . . 0.0 110.866 -173.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.09 36.7 60.36 Favored Glycine 0 N--CA 1.429 -1.771 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.2 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -95.3 -16.6 22.3 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.393 0.616 . . . . 0.0 109.438 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.29 13.19 82.22 Favored Glycine 0 CA--C 1.503 -0.705 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -175.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.434 ' HG2' ' HB3' ' A' ' 99' ' ' TYR . 9.4 tt0 -151.09 144.73 25.01 Favored 'General case' 0 N--CA 1.418 -2.061 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 -176.31 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.552 HG13 ' HB ' ' A' ' 100' ' ' ILE . 2.4 p -97.27 112.21 28.8 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.99 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -172.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.45 ' HB3' ' OE2' ' A' ' 140' ' ' GLU . 45.1 t30 -76.38 162.62 27.72 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.825 178.037 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -56.21 -48.3 76.69 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 123.431 0.693 . . . . 0.0 112.374 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.533 ' HA ' HG22 ' A' ' 142' ' ' VAL . 41.3 mt-10 -66.65 -41.13 88.74 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.262 0.553 . . . . 0.0 111.422 -178.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.45 ' OE2' ' HB3' ' A' ' 137' ' ' ASN . 2.8 mp0 -56.78 -45.71 81.98 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.767 174.063 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -64.73 -50.84 65.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.843 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.533 HG22 ' HA ' ' A' ' 139' ' ' GLU . 24.2 m -62.43 -37.97 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -176.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -51.68 -59.51 4.21 Favored 'General case' 0 C--O 1.233 0.237 0 O-C-N 123.986 0.804 . . . . 0.0 110.482 -177.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.72 -26.68 44.81 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -172.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 2.6 tmm? -80.78 -33.85 34.6 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.275 -0.57 . . . . 0.0 110.959 -174.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 57.6 p -87.69 2.74 50.28 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.593 0.711 . . . . 0.0 110.629 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -82.81 50.51 1.71 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.949 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm . . . . . 0 C--O 1.247 0.93 0 C-N-CA 124.995 1.318 . . . . 0.0 110.01 -177.772 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 17.3 p . . . . . 0 N--CA 1.436 -1.137 0 N-CA-C 107.262 -1.385 . . . . 0.0 107.262 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo -46.34 -44.73 19.93 Favored 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 122.844 2.363 . . . . 0.0 110.606 177.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.95 179.14 8.72 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 172.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -154.4 98.68 2.13 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 173.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 2.7 p -82.03 22.81 0.75 Allowed 'General case' 0 C--N 1.299 -1.626 0 C-N-CA 124.348 1.059 . . . . 0.0 112.971 -175.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 67.05 163.78 0.19 Allowed 'General case' 0 C--O 1.24 0.6 0 C-N-CA 124.514 1.125 . . . . 0.0 112.33 -178.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 61.2 m170 70.74 -36.14 0.35 Allowed 'General case' 0 N--CA 1.504 2.239 0 C-N-CA 125.162 1.385 . . . . 0.0 113.073 -178.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' PHE . . . . . 0.558 ' CZ ' ' HB3' ' A' ' 127' ' ' GLU . 91.2 t80 -55.35 -41.08 72.04 Favored 'General case' 0 C--N 1.315 -0.935 0 C-N-CA 124.91 1.284 . . . . 0.0 112.007 -178.085 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -71.01 -36.74 72.54 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.949 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -69.55 -31.59 69.88 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.432 0.634 . . . . 0.0 109.334 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.98 -54.92 35.04 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.14 173.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 26.9 m95 -57.68 -40.96 80.61 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.341 175.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -54.72 -58.26 8.26 Favored 'General case' 0 CA--C 1.501 -0.934 0 C-N-CA 123.45 0.7 . . . . 0.0 110.169 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -65.49 -30.85 71.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.243 -0.583 . . . . 0.0 112.465 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.08 -47.67 73.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.301 0.572 . . . . 0.0 110.061 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 85.4 mt -66.47 -36.66 77.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.73 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -59.01 -45.36 90.88 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.407 ' CG ' ' HB3' ' A' ' 112' ' ' LEU . 4.0 tppp? -64.55 -43.87 92.59 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.271 175.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.416 ' HB1' HG11 ' A' ' 91' ' ' VAL . . . -61.18 -33.72 73.9 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.318 0.58 . . . . 0.0 110.983 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 22.6 mtpp -87.07 9.02 21.04 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.857 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 12.2 m80 -118.18 96.39 5.31 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.282 0.563 . . . . 0.0 111.917 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 27.5 ptm -85.27 -175.97 0.71 Allowed Pre-proline 0 C--N 1.301 -1.526 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 172.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -68.43 76.54 0.72 Allowed 'Trans proline' 0 C--N 1.352 0.712 0 CA-C-N 121.888 1.71 . . . . 0.0 110.498 172.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 97' ' ' ASP . . . . . 0.441 ' HA ' ' HD3' ' B' ' 98' ' ' PRO . 27.0 t70 -170.47 137.89 1.3 Allowed Pre-proline 0 C--N 1.312 -1.056 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 -177.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 98' ' ' PRO . . . . . 0.531 ' HD3' ' CG ' ' A' ' 51' ' ' MET . 1.3 Cg_endo -83.52 143.66 11.03 Favored 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.447 2.098 . . . . 0.0 113.413 -174.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 99' ' ' TRP . . . . . 0.598 ' HA ' ' SD ' ' A' ' 72' ' ' MET . 36.7 t-105 -140.72 -39.63 0.42 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 114.581 -1.19 . . . . 0.0 108.291 178.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.409 -2.523 1 N-CA-C 100.14 -4.022 . . . . 0.0 100.14 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.765 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -126.98 -39.5 1.94 Allowed 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 177.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.45 ' HA ' ' OE1' ' A' ' 3' ' ' GLN . 14.2 mm-40 -96.26 164.23 12.75 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 175.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.468 HD23 HD22 ' A' ' 69' ' ' LEU . 12.0 tp -126.68 151.44 48.09 Favored 'General case' 0 C--N 1.293 -1.874 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -174.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.9 p -82.59 152.94 25.72 Favored 'General case' 0 N--CA 1.428 -1.564 0 O-C-N 123.364 0.415 . . . . 0.0 110.9 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -53.53 -45.19 69.68 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -171.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.55 -37.91 88.09 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-O 120.733 0.301 . . . . 0.0 110.992 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.426 ' HB3' ' HE1' ' A' ' 76' ' ' MET . 5.8 mm-40 -72.76 -33.09 66.11 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.507 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 36.3 mt -66.08 -34.45 70.34 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.095 176.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.5 -37.78 80.39 Favored 'General case' 0 C--O 1.252 1.21 0 CA-C-O 121.815 0.817 . . . . 0.0 109.88 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -62.75 -40.08 96.13 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.155 176.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -79.75 -16.36 55.74 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 30.5 mmtp -61.92 -47.2 85.98 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 171.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -59.78 -52.95 63.26 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 114.285 -1.325 . . . . 0.0 110.327 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.94 82.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.76 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -65.78 -45.91 80.71 Favored 'General case' 0 C--O 1.206 -1.232 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.601 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 32.1 t -69.25 -23.74 63.9 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 120.732 0.301 . . . . 0.0 111.047 -177.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.292 1.0 OUTLIER -62.1 -57.03 13.09 Favored 'General case' 0 CA--C 1.476 -1.866 0 CA-C-O 123.196 1.474 . . . . 0.0 107.091 174.268 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.493 ' CZ ' HD23 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -74.43 -33.89 63.07 Favored 'General case' 1 N--CA 1.368 -4.564 0 CA-C-N 111.666 -2.515 . . . . 0.0 109.605 -167.72 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -78.19 84.38 4.41 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-O 122.235 1.017 . . . . 0.0 108.416 173.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.7 mmtm -67.75 -32.23 72.68 Favored 'General case' 0 N--CA 1.421 -1.908 0 CA-C-N 113.931 -1.486 . . . . 0.0 112.439 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -87.34 -13.48 43.44 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.919 -176.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.96 50.57 64.33 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 -177.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -113.4 -12.11 13.03 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -176.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.88 5.8 57.34 Favored Glycine 0 C--N 1.306 -1.128 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.309 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.8 p -143.04 145.62 33.07 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 117.758 0.779 . . . . 0.0 111.838 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.8 mt -95.46 118.02 40.74 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 69.6 p -100.79 169.5 8.96 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.139 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 77.8 p -63.31 -30.95 71.99 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 121.255 0.55 . . . . 0.0 109.995 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.1 tttm -50.04 -55.97 12.66 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.759 1.223 . . . . 0.0 109.348 175.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -67.65 -40.07 84.57 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.626 -176.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.493 HD23 ' CZ ' ' A' ' 19' ' ' PHE . 83.9 mt -54.17 -55.85 23.88 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.978 0.894 . . . . 0.0 109.498 177.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.76 -21.38 73.01 Favored Glycine 0 C--O 1.215 -1.093 0 CA-C-N 115.4 -0.818 . . . . 0.0 113.288 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.7 m -74.32 -48.27 29.32 Favored 'General case' 0 C--O 1.254 1.293 0 CA-C-N 117.497 0.648 . . . . 0.0 110.376 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 m -68.64 -32.81 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.463 ' HB3' ' HB3' ' A' ' 41' ' ' GLN . 41.1 mtm -73.26 -27.71 61.73 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -61.24 -39.69 91.25 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.0 m -63.46 -27.55 69.36 Favored 'General case' 0 CA--C 1.554 1.129 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.457 176.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.563 HD11 ' SD ' ' B' ' 95' ' ' MET . 2.4 tm? -88.88 -23.64 22.71 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.194 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 103.74 11.99 31.4 Favored Glycine 0 C--N 1.308 -1.026 0 C-N-CA 120.189 -1.005 . . . . 0.0 112.39 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.463 ' HB3' ' HB3' ' A' ' 36' ' ' MET . 2.4 tp-100 -101.28 125.01 47.86 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 179.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -125.87 75.26 71.2 Favored Pre-proline 0 C--N 1.294 -1.825 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.432 ' HG2' HD21 ' A' ' 48' ' ' LEU . 5.6 Cg_exo -77.64 147.91 25.39 Favored 'Trans proline' 0 N--CA 1.448 -1.164 0 C-N-CA 121.777 1.651 . . . . 0.0 109.977 176.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.5 p -68.56 154.02 42.66 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-O 120.533 0.206 . . . . 0.0 110.845 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -59.48 -30.57 68.63 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 122.801 0.44 . . . . 0.0 110.982 -177.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.27 78.54 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.338 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 51' ' ' MET . 55.2 mm-40 -65.97 -43.34 88.14 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.98 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.432 HD21 ' HG2' ' A' ' 43' ' ' PRO . 85.6 mt -67.43 -34.15 76.62 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.327 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.41 -44.77 90.19 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 178.181 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.56 -41.22 98.42 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.35 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 67.5 mtt -61.84 -42.53 99.14 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.084 178.099 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.9 mt -63.36 -45.07 99.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.998 0.428 . . . . 0.0 110.584 176.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -58.59 -18.28 28.8 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -175.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -64.82 -41.49 95.72 Favored 'General case' 0 N--CA 1.39 -3.472 0 O-C-N 121.783 -0.573 . . . . 0.0 110.051 177.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.582 HG11 ' SD ' ' A' ' 71' ' ' MET . 17.1 m -104.74 -17.33 7.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.429 -178.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -67.89 113.43 5.61 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -178.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.7 -23.73 36.61 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.229 0.537 . . . . 0.0 110.612 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -99.01 -11.89 21.1 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.399 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.52 51.55 57.12 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.642 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -115.22 -4.19 12.46 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 120.84 0.353 . . . . 0.0 111.906 -176.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.56 13.66 37.4 Favored Glycine 0 N--CA 1.438 -1.22 0 C-N-CA 120.829 -0.701 . . . . 0.0 113.299 174.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 11.2 p -141.48 139.55 33.35 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.882 0.341 . . . . 0.0 110.564 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 mt -91.47 113.25 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.941 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -83.85 166.19 18.13 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.463 ' CE2' HD11 ' A' ' 69' ' ' LEU . 56.5 t80 -56.79 -57.69 22.36 Favored Pre-proline 0 CA--C 1.555 1.145 0 O-C-N 123.568 0.543 . . . . 0.0 112.213 -177.173 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.17 -39.51 90.62 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.496 2.131 . . . . 0.0 112.539 177.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -63.4 -44.97 93.15 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.332 0.586 . . . . 0.0 110.287 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.63 -26.32 57.66 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.665 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.468 HD22 HD23 ' A' ' 4' ' ' LEU . 80.4 mt -63.98 -42.1 97.33 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 174.279 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.41 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 47.2 m -56.4 -48.69 76.4 Favored 'General case' 0 C--O 1.239 0.544 0 O-C-N 123.835 0.709 . . . . 0.0 109.152 175.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.582 ' SD ' HG11 ' A' ' 55' ' ' VAL . 40.4 ttp -54.65 -55.4 30.0 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.841 177.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 20.7 mmt -62.33 -38.62 90.16 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.4 -19.31 63.81 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 70' ' ' THR . 95.0 mtt180 -84.11 -29.86 26.42 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.23 0.538 . . . . 0.0 110.507 173.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -83.68 -33.74 25.12 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.803 0.811 . . . . 0.0 109.996 -176.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.426 ' HE1' ' HB3' ' A' ' 8' ' ' GLN . 34.9 ttm -84.42 122.67 29.29 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.842 -176.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 80.1 tttt 60.13 95.07 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.156 1.535 . . . . 0.0 111.582 171.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 79.31 123.59 0.05 OUTLIER 'General case' 0 CA--C 1.496 -1.133 0 C-N-CA 125.058 1.343 . . . . 0.0 111.73 -175.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.533 ' OG1' ' HA ' ' A' ' 82' ' ' GLU . 3.1 p -114.73 172.5 7.0 Favored 'General case' 0 C--N 1.277 -2.558 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.384 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -91.47 -44.91 8.83 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.839 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.6 m -120.22 14.26 12.13 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.297 0.57 . . . . 0.0 110.086 178.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.533 ' HA ' ' OG1' ' A' ' 79' ' ' THR . 10.6 mm-40 63.31 18.75 11.24 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.998 1.319 . . . . 0.0 110.88 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.48 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -60.34 -45.43 93.48 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.312 -1.313 . . . . 0.0 112.331 -175.715 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -59.52 -42.69 92.84 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 121.776 0.798 . . . . 0.0 110.356 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.461 HG21 HG12 ' A' ' 142' ' ' VAL . 8.0 mm -70.6 -42.87 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 CA-C-N 114.113 -1.403 . . . . 0.0 108.929 -173.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -71.16 -38.08 72.2 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.682 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.507 ' HB2' ' HE2' ' B' ' 93' ' ' LYS . 52.5 mt-10 -58.62 -46.82 86.24 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 175.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.76 -40.1 91.71 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.094 -179.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -65.44 -49.33 69.54 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.16 0.505 . . . . 0.0 109.966 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 24.5 ttp85 -58.35 -38.79 77.9 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.375 1.07 . . . . 0.0 112.432 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 9.6 p -75.97 -19.57 15.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.643 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -86.69 -50.81 6.52 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.453 174.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -95.59 76.46 3.28 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.947 0.879 . . . . 0.0 110.994 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -79.06 -29.4 43.44 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.542 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.99 -12.98 61.49 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.241 0.543 . . . . 0.0 111.457 -178.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.56 48.47 10.5 Favored Glycine 0 N--CA 1.435 -1.407 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.743 176.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -80.92 -19.91 43.24 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.23 -0.38 85.66 Favored Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 110.759 -0.937 . . . . 0.0 110.759 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.1 p90 -156.74 158.24 36.54 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -178.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.576 ' HB ' HG13 ' A' ' 136' ' ' VAL . 1.7 mt -87.41 106.09 15.84 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.3 t -93.82 143.71 26.09 Favored 'General case' 0 N--CA 1.422 -1.825 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.499 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.56 -38.99 92.93 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 123.218 0.607 . . . . 0.0 111.45 -177.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.7 -46.21 89.76 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.394 0.616 . . . . 0.0 109.981 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.581 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 2.8 tp10 -66.71 -45.64 78.08 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.392 176.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.99 -35.99 78.28 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -175.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.498 ' HB2' HG21 ' A' ' 121' ' ' VAL . 29.5 ttp180 -64.96 -36.2 83.63 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.296 177.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.581 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 42.9 m170 -56.72 -50.97 70.6 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.124 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.697 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.1 p -70.72 -33.06 51.31 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.838 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.36 -177.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 20.9 mmt -62.3 -46.72 87.48 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.3 m -65.23 -30.88 71.81 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.374 0.607 . . . . 0.0 109.498 177.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -71.89 -32.32 67.31 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.462 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 71.9 mt -85.47 -19.38 31.33 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 121.024 0.44 . . . . 0.0 110.69 -176.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.54 14.15 57.35 Favored Glycine 0 N--CA 1.434 -1.435 0 C-N-CA 120.56 -0.828 . . . . 0.0 111.606 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.428 ' OE1' ' HG3' ' B' ' 91' ' ' LYS . 30.9 mm-40 -74.48 -36.85 63.3 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 55.94 62.23 2.47 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 122.421 1.105 . . . . 0.0 110.78 178.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 71.2 mt -92.81 147.13 23.11 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.2 p -77.84 174.43 11.03 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 120.354 -0.538 . . . . 0.0 110.462 -179.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -68.37 -38.05 81.01 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.149 0.499 . . . . 0.0 109.705 -178.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 119' ' ' GLU . 1.4 mp0 -63.45 -42.49 98.64 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 177.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -61.99 -54.85 35.96 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.437 1.095 . . . . 0.0 110.53 -177.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.498 HG21 ' HB2' ' A' ' 106' ' ' ARG . 25.3 m -63.39 -36.98 78.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.002 -177.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -72.18 -32.35 66.75 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.699 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -64.2 -47.58 79.21 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 mtt -51.68 -50.47 60.36 Favored 'General case' 0 CA--C 1.503 -0.844 0 O-C-N 123.601 0.563 . . . . 0.0 110.381 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.532 ' CG2' ' HA ' ' A' ' 135' ' ' GLN . 40.4 mm -60.11 -49.46 83.99 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.538 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.143 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.4 ttm180 -65.64 -30.82 71.58 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 123.298 0.639 . . . . 0.0 111.474 -175.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -78.03 -34.03 50.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.842 0.353 . . . . 0.0 110.683 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.13 -28.12 42.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.648 0.737 . . . . 0.0 109.282 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -74.84 94.4 2.77 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.681 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.433 ' HB ' ' HG3' ' A' ' 140' ' ' GLU . 9.6 mt -82.19 -19.06 10.81 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.804 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.151 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -82.62 -11.5 58.34 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.591 -173.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.3 24.06 72.06 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.177 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -87.11 -17.08 33.65 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.44 0.638 . . . . 0.0 109.768 -177.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 97.01 -18.62 57.2 Favored Glycine 0 N--CA 1.437 -1.277 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.192 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.532 ' HA ' ' CG2' ' A' ' 125' ' ' ILE . 31.8 mt-30 -134.44 147.33 50.41 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.576 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.7 p -94.76 124.03 47.1 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -173.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -93.4 175.4 6.77 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.547 ' O ' HG13 ' A' ' 142' ' ' VAL . 73.5 t80 -60.19 -45.69 92.26 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -175.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.638 ' O ' HG22 ' A' ' 142' ' ' VAL . 35.6 mm-40 -61.59 -43.58 98.6 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.331 0.586 . . . . 0.0 111.644 -179.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.433 ' HG3' ' HB ' ' A' ' 130' ' ' ILE . 0.3 OUTLIER -68.14 -33.79 75.14 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.041 178.546 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -67.72 -38.97 84.3 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.998 176.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.638 HG22 ' O ' ' A' ' 139' ' ' GLU . 7.2 m -59.05 -38.53 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.46 -178.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -76.37 -41.46 48.01 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.617 -175.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 3.7 ppp? -76.52 -32.2 58.13 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.155 -0.618 . . . . 0.0 112.101 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.5 tpt -71.56 -26.0 62.44 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.114 0.483 . . . . 0.0 110.571 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 39.1 p -98.3 7.44 46.22 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.381 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.21 82.23 6.31 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-O 121.204 0.526 . . . . 0.0 111.275 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt . . . . . 0 N--CA 1.434 -1.269 0 CA-C-O 118.044 -0.979 . . . . 0.0 108.399 177.574 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 30.8 m . . . . . 0 N--CA 1.44 -0.964 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -71.96 -13.85 29.14 Favored 'Trans proline' 0 C--N 1.362 1.281 0 C-N-CA 123.021 2.48 . . . . 0.0 114.701 -175.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -119.69 -64.41 1.27 Allowed 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 177.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 59.5 t30 61.61 30.96 18.82 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.211 1.004 . . . . 0.0 110.212 175.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' SER . . . . . 0.492 ' O ' ' HB3' ' B' ' 81' ' ' PHE . 32.0 t -67.76 -33.63 75.23 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.508 1.123 . . . . 0.0 112.82 -173.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -76.58 -31.62 57.63 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.384 0.612 . . . . 0.0 109.858 -178.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -77.89 -28.84 49.97 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.538 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' PHE . . . . . 0.492 ' HB3' ' O ' ' B' ' 78' ' ' SER . 46.6 t80 -53.28 -42.35 66.48 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.786 1.235 . . . . 0.0 110.723 177.57 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp -63.41 -47.83 80.35 Favored 'General case' 0 N--CA 1.418 -2.04 0 C-N-CA 123.217 0.607 . . . . 0.0 110.747 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -58.92 -55.49 34.42 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.481 1.134 . . . . 0.0 108.675 176.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.03 -50.99 60.33 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 112.613 -2.085 . . . . 0.0 112.263 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -72.6 -28.6 62.88 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -58.84 -55.93 28.77 Favored 'General case' 0 CA--C 1.481 -1.693 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 172.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -46.66 -58.33 3.94 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 125.113 1.508 . . . . 0.0 111.333 175.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.12 -52.85 62.85 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 45.4 mm -65.14 -49.01 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-O 120.99 0.424 . . . . 0.0 110.102 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 90' ' ' GLN . . . . . 0.471 ' O ' ' HB2' ' B' ' 94' ' ' HIS . 57.2 tt0 -60.92 -37.35 81.98 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.968 0.907 . . . . 0.0 112.047 -176.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.428 ' HG3' ' OE1' ' A' ' 114' ' ' GLU . 14.0 mmmm -81.73 -42.18 20.2 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' B' ' 94' ' ' HIS . . . -77.95 -51.26 10.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.074 0.464 . . . . 0.0 111.588 -177.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.507 ' HE2' ' HB2' ' A' ' 87' ' ' GLU . 58.2 tttm -77.9 10.83 2.53 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.356 1.074 . . . . 0.0 110.321 -175.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 94' ' ' HIS . . . . . 0.471 ' HB2' ' O ' ' B' ' 90' ' ' GLN . 4.7 t60 -74.68 -7.6 53.75 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 125.699 1.599 . . . . 0.0 109.676 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.563 ' SD ' HD11 ' A' ' 39' ' ' LEU . 93.0 mmm -53.43 -55.74 31.62 Favored Pre-proline 0 CA--C 1.551 0.982 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.471 -179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.514 ' HD3' ' HB2' ' B' ' 95' ' ' MET . 16.1 Cg_endo -101.22 44.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.365 1.402 0 C-N-CA 122.806 2.338 . . . . 0.0 109.755 177.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 15.3 t70 74.08 135.86 0.05 OUTLIER Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 125.804 1.642 . . . . 0.0 112.097 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -75.54 -14.49 19.99 Favored 'Trans proline' 0 C--O 1.255 1.355 0 C-N-CA 122.862 2.374 . . . . 0.0 114.57 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 65.7 m95 71.23 -46.52 0.64 Allowed 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 126.378 1.871 . . . . 0.0 111.943 -176.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.92 0 C-N-CA 125.785 1.634 . . . . 0.0 107.848 175.327 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.487 0 CA-C-O 120.647 0.26 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -134.19 156.04 49.06 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -126.38 36.45 4.49 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 176.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.428 ' HB3' HD11 ' A' ' 9' ' ' ILE . 11.1 tp -72.94 140.95 47.78 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.322 -173.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.5 p -82.65 153.76 25.24 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.255 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -53.62 -44.05 69.18 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 125.018 1.327 . . . . 0.0 110.959 -176.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -55.89 -49.01 74.6 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.107 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -68.57 -47.22 67.36 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.722 -178.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.622 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 60.3 mt -57.37 -40.24 73.02 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.464 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.329 -178.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.31 -49.03 79.38 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-O 120.792 0.33 . . . . 0.0 111.4 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -60.2 -41.18 92.43 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.637 0.732 . . . . 0.0 109.578 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.494 ' CE2' ' HG2' ' A' ' 72' ' ' MET . 36.5 m-85 -77.27 -13.62 59.9 Favored 'General case' 0 C--O 1.207 -1.156 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.622 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 97.7 mttt -69.64 -43.41 72.67 Favored 'General case' 0 C--O 1.249 1.059 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 173.229 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -64.64 -45.45 86.76 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.014 -0.993 . . . . 0.0 110.18 176.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.454 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -58.52 -47.88 82.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.356 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -57.03 -49.15 76.7 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.336 0.655 . . . . 0.0 111.196 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.3 m -76.99 -19.61 57.08 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.234 -174.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 15' ' ' ALA . 4.5 pp -79.21 -21.98 45.52 Favored 'General case' 0 CA--C 1.502 -0.9 0 C-N-CA 118.979 -1.088 . . . . 0.0 110.741 176.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.462 ' CE2' ' HA ' ' A' ' 32' ' ' LEU . 2.7 t80 -80.7 -50.85 9.37 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.46 79.72 3.17 Favored 'General case' 0 N--CA 1.416 -2.145 0 CA-C-N 113.012 -1.904 . . . . 0.0 110.47 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -54.58 -34.39 61.85 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 113.584 -1.644 . . . . 0.0 112.793 -175.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -92.87 -8.18 44.12 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.734 -170.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.5 37.12 94.02 Favored Glycine 0 C--O 1.235 0.208 0 C-N-CA 121.344 -0.455 . . . . 0.0 112.626 177.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -100.87 -16.2 17.32 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 122.755 -0.262 . . . . 0.0 111.288 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.5 6.96 76.59 Favored Glycine 0 N--CA 1.439 -1.126 0 C-N-CA 120.554 -0.831 . . . . 0.0 114.4 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.8 p -128.68 130.69 47.53 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 118.063 0.931 . . . . 0.0 109.737 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 51.2 mt -96.15 122.01 47.24 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.492 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.4 p -101.86 168.32 9.5 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.037 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.426 HG23 HD12 ' A' ' 52' ' ' ILE . 32.4 p -64.84 -27.74 69.08 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.131 0.491 . . . . 0.0 110.496 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -57.47 -57.16 13.87 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 177.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.49 -37.9 89.16 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 114.543 -1.208 . . . . 0.0 111.834 -176.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 28' ' ' THR . 96.4 mt -52.85 -62.84 1.39 Allowed 'General case' 0 CA--C 1.501 -0.932 0 O-C-N 124.237 0.961 . . . . 0.0 109.85 178.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.07 -28.52 71.56 Favored Glycine 0 N--CA 1.428 -1.861 0 C-N-CA 119.875 -1.155 . . . . 0.0 113.268 -176.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.3 m -60.82 -55.36 34.01 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 118.105 0.953 . . . . 0.0 111.007 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.69 -35.05 30.12 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.746 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.3 mtp -64.98 -37.29 87.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.419 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -64.85 -40.77 95.68 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 122.703 0.401 . . . . 0.0 110.027 176.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.4 m -65.4 -26.82 68.16 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.371 0.605 . . . . 0.0 110.339 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.423 ' HB3' ' HE3' ' B' ' 91' ' ' LYS . 4.6 mm? -94.72 8.98 40.68 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.785 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.447 ' HA3' ' HA3' ' A' ' 113' ' ' GLY . . . 87.03 35.54 9.72 Favored Glycine 0 C--N 1.312 -0.786 0 C-N-CA 120.032 -1.08 . . . . 0.0 115.719 172.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -143.16 121.78 12.53 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 172.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -116.06 84.49 13.71 Favored Pre-proline 0 C--N 1.309 -1.183 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.723 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.657 ' HG2' HD21 ' A' ' 48' ' ' LEU . 19.1 Cg_endo -84.47 169.22 11.07 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.386 2.058 . . . . 0.0 111.655 176.208 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.0 p -96.48 170.3 9.31 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.848 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -56.49 -42.48 78.36 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.55 1.14 . . . . 0.0 110.368 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.24 -47.77 84.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.364 -178.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -63.73 -43.69 95.74 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.361 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.657 HD21 ' HG2' ' A' ' 43' ' ' PRO . 94.1 mt -62.7 -34.09 76.42 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.709 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -72.58 -34.39 67.42 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.69 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -65.68 -42.26 91.46 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.2 mtt -55.28 -42.84 74.1 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.655 177.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.426 HD12 HG23 ' A' ' 29' ' ' THR . 33.3 mt -71.16 -56.52 10.27 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.612 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.815 176.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -54.22 -31.04 52.15 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -174.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.94 -42.5 89.96 Favored 'General case' 0 N--CA 1.415 -2.19 0 C-N-CA 124.009 0.924 . . . . 0.0 110.744 175.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.55 HG11 ' SD ' ' A' ' 71' ' ' MET . 9.5 m -102.84 -18.9 6.37 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.194 -175.225 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -68.63 109.7 3.9 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.56 -40.33 21.06 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.041 -173.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -94.44 -9.91 34.07 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.143 -176.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.88 53.24 31.83 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.977 177.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.2 p-10 -107.6 -9.71 15.82 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 120.65 -0.42 . . . . 0.0 111.241 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 106.95 -0.05 35.94 Favored Glycine 0 N--CA 1.439 -1.159 0 C-N-CA 120.386 -0.911 . . . . 0.0 113.306 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.5 p -135.27 151.33 50.47 Favored 'General case' 0 C--O 1.249 1.068 0 CA-C-N 117.609 0.705 . . . . 0.0 111.888 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.1 mt -93.71 110.34 23.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 175.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -82.49 175.11 10.47 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 177.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.448 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 59.8 t80 -61.08 -52.9 68.56 Favored Pre-proline 0 C--N 1.302 -1.487 0 CA-C-O 119.255 -0.403 . . . . 0.0 111.484 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -53.02 -34.94 69.89 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.769 2.313 . . . . 0.0 112.522 174.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -74.39 -39.87 62.4 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -61.85 -42.54 99.17 Favored 'General case' 0 C--O 1.246 0.889 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 76.3 mt -60.47 -46.55 89.66 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.022 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.2 m -57.89 -42.22 84.18 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 123.52 0.512 . . . . 0.0 110.853 177.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.55 ' SD ' HG11 ' A' ' 55' ' ' VAL . 30.6 ttp -57.79 -45.92 85.35 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 121.021 0.439 . . . . 0.0 111.451 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.494 ' HG2' ' CE2' ' A' ' 12' ' ' PHE . 34.6 tpp -76.3 -33.74 59.06 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.222 -176.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.35 -21.73 62.0 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.745 -179.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -83.64 -27.49 29.09 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 121.549 0.69 . . . . 0.0 109.663 173.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -86.39 -38.66 17.17 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.302 -173.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.411 ' HG2' ' OE1' ' A' ' 84' ' ' GLU . 32.5 mtm -99.11 -30.81 12.09 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.99 -178.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.413 ' HG2' ' H ' ' A' ' 78' ' ' ASP . 43.3 tttp -119.34 176.59 5.26 Favored 'General case' 0 N--CA 1.414 -2.268 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 -172.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.413 ' H ' ' HG2' ' A' ' 77' ' ' LYS . 35.9 t70 67.32 20.37 10.03 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 123.676 1.703 . . . . 0.0 108.33 -174.041 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.5 t -163.43 127.39 2.82 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-N 112.901 -1.954 . . . . 0.0 107.394 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -118.12 -25.08 6.77 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -173.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.9 m -88.42 71.65 8.99 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -171.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 53.63 41.99 31.96 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 114.082 -1.417 . . . . 0.0 113.183 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -60.46 -62.73 1.65 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.411 ' OE1' ' HG2' ' A' ' 76' ' ' MET . 45.3 mt-10 -67.04 -35.09 79.12 Favored 'General case' 0 CA--C 1.485 -1.539 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.315 -178.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.407 ' CG2' HG12 ' A' ' 142' ' ' VAL . 26.8 mm -61.13 -46.02 97.44 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.408 -176.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.1 ttp-105 -67.97 -50.16 57.37 Favored 'General case' 0 C--O 1.196 -1.745 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.032 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -55.49 -39.2 70.12 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.5 86.81 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 120.501 0.191 . . . . 0.0 111.132 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -71.57 -49.15 43.28 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -56.59 -32.5 65.29 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 126.521 1.929 . . . . 0.0 112.485 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.52 -28.63 16.11 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 C-N-CA 120.197 -0.601 . . . . 0.0 111.304 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -81.6 -47.64 12.78 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 174.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -83.84 61.74 6.55 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 122.974 1.369 . . . . 0.0 107.452 175.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -77.84 -24.03 48.76 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.415 -172.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -93.49 -13.34 27.97 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.497 0.665 . . . . 0.0 110.359 -177.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.2 62.85 1.46 Allowed Glycine 0 N--CA 1.435 -1.372 0 C-N-CA 120.494 -0.86 . . . . 0.0 111.589 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -106.02 -19.26 13.78 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-O 121.587 0.708 . . . . 0.0 109.246 177.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.08 -13.38 59.73 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.672 175.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.412 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 83.4 m-85 -139.7 132.32 28.84 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -176.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.57 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.7 mt -80.37 121.82 34.48 Favored 'Isoleucine or valine' 0 C--O 1.252 1.225 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.4 m -101.19 161.73 13.4 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 123.349 0.406 . . . . 0.0 109.978 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.12 -52.89 20.1 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -172.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.33 -29.98 69.68 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 121.73 0.776 . . . . 0.0 109.226 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.18 -39.85 93.44 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.307 -1.315 . . . . 0.0 110.499 175.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.512 HD22 HG12 ' A' ' 121' ' ' VAL . 4.9 tt -64.85 -45.79 84.61 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 177.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.511 ' HG3' HG11 ' A' ' 121' ' ' VAL . 51.0 mtp180 -61.35 -35.67 78.06 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.919 -0.488 . . . . 0.0 111.67 175.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -61.37 -51.56 68.29 Favored 'General case' 0 C--O 1.259 1.587 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.818 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.63 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 10.5 p -65.59 -35.41 75.17 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.635 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.911 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.458 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.0 mmt -60.75 -40.18 91.5 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 56.8 m -59.87 -40.9 90.22 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 176.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -72.96 -26.82 61.51 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.491 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 81.8 mt -86.56 -7.45 58.36 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.166 0.507 . . . . 0.0 109.901 -178.305 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLY . . . . . 0.447 ' HA3' ' HA3' ' A' ' 40' ' ' GLY . . . 70.37 13.6 70.91 Favored Glycine 0 N--CA 1.432 -1.586 0 CA-C-N 115.085 -0.961 . . . . 0.0 113.168 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -86.84 -35.4 19.08 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp 57.15 94.78 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.307 1.043 . . . . 0.0 111.954 176.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 72.0 mt -110.91 155.86 22.03 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 120.894 0.378 . . . . 0.0 111.292 -176.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.0 p -85.37 161.12 19.6 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.607 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -64.26 -41.14 97.08 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -69.06 -33.36 73.45 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.646 0.736 . . . . 0.0 110.307 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -68.15 -51.59 44.19 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.583 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.512 HG12 HD22 ' A' ' 105' ' ' LEU . 16.7 m -67.79 -30.57 48.9 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.429 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.325 178.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.93 -44.01 90.89 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.299 178.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.97 -43.67 98.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 65.4 mtt -56.65 -55.0 39.58 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 124.01 0.819 . . . . 0.0 111.038 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.2 mm -58.11 -55.37 22.52 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.416 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.724 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 -58.14 -43.15 87.17 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 113.186 0.809 . . . . 0.0 113.186 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -76.09 -28.43 57.56 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.396 -176.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -80.12 -28.78 38.92 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.691 0.758 . . . . 0.0 110.076 177.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -76.42 85.45 3.16 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 122.118 0.961 . . . . 0.0 110.664 178.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.0 mt -78.01 -23.29 13.79 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.903 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -83.19 -10.97 58.3 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.907 0.384 . . . . 0.0 111.134 -175.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.34 37.55 70.6 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -94.97 -16.89 22.43 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 121.647 0.737 . . . . 0.0 109.417 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 97.47 -14.75 63.02 Favored Glycine 0 N--CA 1.444 -0.825 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -177.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.412 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 27.2 mp0 -133.98 138.36 45.38 Favored 'General case' 0 CA--C 1.49 -1.361 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 178.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.57 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.7 OUTLIER -80.75 121.46 34.26 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 CA-C-O 121.183 0.516 . . . . 0.0 111.815 -177.904 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.574 ' HB3' ' OE2' ' A' ' 140' ' ' GLU . 50.8 t30 -87.99 166.67 14.32 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.925 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.555 ' O ' HG13 ' A' ' 142' ' ' VAL . 91.1 t80 -61.07 -45.44 94.71 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 123.223 0.609 . . . . 0.0 112.318 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.48 ' O ' HG22 ' A' ' 142' ' ' VAL . 15.1 mm-40 -65.41 -40.86 93.89 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.282 0.563 . . . . 0.0 111.732 -178.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.574 ' OE2' ' HB3' ' A' ' 137' ' ' ASN . 4.8 mp0 -60.54 -43.62 97.0 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.272 175.274 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -60.09 -47.04 87.55 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.881 176.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.555 HG13 ' O ' ' A' ' 138' ' ' TYR . 4.4 m -63.6 -39.2 84.47 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.491 -178.002 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -65.49 -42.5 92.1 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.042 -176.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.473 ' HG3' ' N ' ' A' ' 145' ' ' MET . 3.4 ptm -78.62 -37.55 41.94 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 119.937 -0.705 . . . . 0.0 111.726 -178.294 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.473 ' N ' ' HG3' ' A' ' 144' ' ' MET . 3.0 tmm? -72.87 -38.23 67.08 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.999 -171.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 15.5 m -81.08 -28.03 35.41 Favored 'General case' 0 C--N 1.308 -1.203 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.798 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -95.92 80.65 3.35 Favored 'General case' 0 C--N 1.316 -0.872 0 O-C-N 121.681 -0.637 . . . . 0.0 110.534 178.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.3 mttp . . . . . 0 C--N 1.307 -1.255 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.078 179.898 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.428 -1.555 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -58.46 -46.44 24.35 Favored 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 122.473 2.115 . . . . 0.0 111.562 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -83.81 74.43 10.19 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.99 0.9 . . . . 0.0 110.433 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -153.94 35.69 0.44 Allowed 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -41.17 -71.83 0.07 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.949 1.7 . . . . 0.0 115.207 -172.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -107.97 61.4 0.61 Allowed 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 176.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 60.34 26.71 16.24 Favored 'General case' 0 C--O 1.208 -1.097 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.861 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -42.91 -52.29 5.2 Favored 'General case' 0 C--O 1.21 -1.005 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -77.6 -27.1 51.19 Favored 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 119.522 -0.871 . . . . 0.0 112.341 -175.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -73.54 -43.06 60.84 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 176.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.68 -34.86 65.07 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.857 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -73.43 -36.11 65.89 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -58.57 -53.88 53.39 Favored 'General case' 0 CA--C 1.493 -1.214 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 174.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -57.52 -40.19 78.18 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 114.553 -1.203 . . . . 0.0 112.756 176.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.85 -54.72 38.29 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 122.46 0.304 . . . . 0.0 111.382 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.573 ' O ' ' HB3' ' B' ' 93' ' ' LYS . 44.3 pt -64.33 -35.82 75.29 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 CA-C-O 120.941 0.4 . . . . 0.0 110.611 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 90' ' ' GLN . . . . . 0.604 ' O ' ' HB3' ' B' ' 94' ' ' HIS . 47.4 tt0 -69.59 -41.16 76.15 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.421 179.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' B' ' 95' ' ' MET . 23.4 tptm -65.34 -45.49 84.02 Favored 'General case' 0 C--O 1.205 -1.248 0 C-N-CA 122.701 0.401 . . . . 0.0 110.508 -177.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.6 -47.55 11.97 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -175.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.573 ' HB3' ' O ' ' B' ' 89' ' ' ILE . 0.3 OUTLIER -74.5 -5.53 43.17 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-O 121.529 0.68 . . . . 0.0 112.083 -177.435 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 94' ' ' HIS . . . . . 0.604 ' HB3' ' O ' ' B' ' 90' ' ' GLN . 26.8 t60 -137.38 24.24 2.95 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.819 0.819 . . . . 0.0 109.522 -178.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.47 ' HB2' ' O ' ' B' ' 91' ' ' LYS . 53.2 ttp -68.36 -53.08 18.96 Favored Pre-proline 0 CA--C 1.552 1.036 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.46 27.23 0.59 Allowed 'Trans proline' 0 C--N 1.368 1.569 0 C-N-CA 121.902 1.735 . . . . 0.0 113.022 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -125.61 168.09 14.78 Favored Pre-proline 0 C--N 1.305 -1.345 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 177.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_exo -60.11 110.1 0.72 Allowed 'Trans proline' 0 C--O 1.244 0.803 0 N-CA-C 107.558 -1.747 . . . . 0.0 107.558 168.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 99' ' ' TRP . . . . . 0.418 ' HE1' ' HG2' ' B' ' 90' ' ' GLN . 14.2 t90 -76.64 84.92 3.3 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -170.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.287 -2.152 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 174.813 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.493 ' HB3' ' HA ' ' A' ' 74' ' ' ARG . . . . . . . . 0 C--O 1.217 -0.635 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -133.34 24.82 4.15 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.514 ' OE1' ' HG2' ' A' ' 77' ' ' LYS . 88.9 mt-30 -74.5 85.43 2.03 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.535 0.683 . . . . 0.0 112.741 -175.207 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.433 HD12 ' HE1' ' A' ' 76' ' ' MET . 1.2 tp -133.11 111.41 10.91 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.439 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 45.5 p -80.73 156.2 26.36 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.869 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -57.22 -33.33 67.43 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 123.45 0.7 . . . . 0.0 112.345 -174.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.512 ' CD ' ' H ' ' A' ' 7' ' ' GLU . 2.0 mp0 -61.01 -46.2 91.73 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.022 0.915 . . . . 0.0 109.293 178.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.463 ' O ' ' HB3' ' A' ' 11' ' ' GLU . 62.0 tt0 -75.08 -33.17 61.62 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 114.623 -1.172 . . . . 0.0 110.14 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.628 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 67.3 mt -63.98 -37.32 79.5 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.57 -40.89 88.83 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 122.631 0.372 . . . . 0.0 110.725 175.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.463 ' HB3' ' O ' ' A' ' 8' ' ' GLN . 10.3 tp10 -57.13 -50.75 71.84 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 174.6 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -62.68 -30.27 71.27 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.936 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.628 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 91.1 mttt -62.14 -48.26 80.89 Favored 'General case' 0 C--O 1.252 1.224 0 CA-C-O 121.243 0.544 . . . . 0.0 110.477 179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -71.98 -43.73 64.66 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.103 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.56 -48.58 74.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.927 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.54 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 56.7 t80 -58.15 -55.34 36.28 Favored 'General case' 0 C--O 1.189 -2.098 0 C-N-CA 124.082 0.953 . . . . 0.0 110.425 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.9 m -68.72 -17.02 63.99 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 123.402 0.438 . . . . 0.0 111.677 -174.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.87 -43.25 84.05 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 174.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.639 ' HB2' HG11 ' A' ' 35' ' ' VAL . 35.2 p90 -96.6 -24.06 16.21 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 119.713 -0.795 . . . . 0.0 111.945 -178.008 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -79.18 81.55 5.43 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 168.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -58.45 -31.43 67.77 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.466 -1.697 . . . . 0.0 114.241 -169.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.435 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 34.3 m-20 -88.05 -13.0 42.66 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.311 -0.956 . . . . 0.0 111.845 178.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.94 61.09 6.77 Favored Glycine 0 CA--C 1.518 0.233 0 O-C-N 123.285 0.365 . . . . 0.0 112.318 -179.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.435 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 5.3 m-20 -111.09 -16.8 13.39 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.108 0.48 . . . . 0.0 109.889 -175.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.8 13.87 64.02 Favored Glycine 0 C--O 1.215 -1.087 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -174.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.598 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 17.2 p -143.41 138.42 29.34 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 122.989 0.516 . . . . 0.0 109.973 177.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mt -104.81 127.7 59.08 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 177.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.7 p -98.86 171.55 8.0 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.1 p -58.93 -39.41 81.49 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 120.984 0.421 . . . . 0.0 110.502 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -50.66 -55.1 17.98 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.014 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -66.82 -44.29 81.53 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.755 -174.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 75.6 mt -53.6 -51.68 62.26 Favored 'General case' 0 CA--C 1.51 -0.579 0 O-C-N 123.851 0.719 . . . . 0.0 111.105 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.534 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -72.9 -37.02 57.09 Favored Glycine 0 C--O 1.192 -2.471 0 C-N-CA 119.25 -1.452 . . . . 0.0 112.832 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.2 m -58.73 -48.36 81.44 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-N 118.593 1.196 . . . . 0.0 110.716 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.639 HG11 ' HB2' ' A' ' 19' ' ' PHE . 17.0 m -67.59 -34.71 69.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.31 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.3 mtm -73.37 -37.0 66.18 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 31.2 mtm180 -66.43 -30.31 70.64 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.7 m -71.74 -30.68 65.88 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.496 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.7 mt -84.07 -15.18 48.36 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.816 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.5 37.1 1.97 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.697 -0.764 . . . . 0.0 114.633 175.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -148.42 131.17 16.0 Favored 'General case' 0 CA--C 1.503 -0.858 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 173.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -114.98 80.36 6.74 Favored Pre-proline 0 C--N 1.31 -1.133 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.639 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -76.12 154.44 37.33 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.154 1.903 . . . . 0.0 110.688 175.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.6 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 51.8 p -83.31 164.05 20.29 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -178.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -66.56 -27.1 67.47 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 -177.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.24 -45.13 91.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.313 0.577 . . . . 0.0 109.685 175.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' A' ' 51' ' ' MET . 34.5 mt-10 -67.49 -48.3 67.51 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.621 178.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 44' ' ' THR . 73.9 mt -57.27 -41.32 79.46 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.162 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 -70.42 -35.59 73.51 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.02 -178.276 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.47 -41.01 85.3 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.629 ' HB3' ' SD ' ' B' ' 95' ' ' MET . 66.4 mtt -54.89 -46.07 74.77 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.194 176.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 67.6 mt -67.19 -55.11 18.82 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.778 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.311 178.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.448 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.6 t30 -55.72 -32.64 63.52 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -171.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -61.73 -36.75 81.88 Favored 'General case' 0 N--CA 1.385 -3.707 0 C-N-CA 123.408 0.683 . . . . 0.0 112.587 178.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.538 HG11 ' HB2' ' A' ' 71' ' ' MET . 34.5 m -98.43 -13.95 7.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-O 120.909 0.385 . . . . 0.0 110.149 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.448 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 33.2 t0 -79.21 105.61 10.66 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.89 -177.151 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.49 -9.31 56.48 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.964 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.17 -11.8 31.88 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.197 -176.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.99 37.59 91.68 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.799 -176.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -115.17 -14.96 11.71 Favored 'General case' 0 C--N 1.32 -0.712 0 O-C-N 122.673 -0.31 . . . . 0.0 111.248 -176.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.23 23.16 32.78 Favored Glycine 0 N--CA 1.433 -1.517 0 C-N-CA 120.438 -0.886 . . . . 0.0 113.385 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.7 p -133.57 136.74 45.12 Favored 'General case' 0 C--O 1.252 1.203 0 CA-C-N 117.37 0.585 . . . . 0.0 111.379 178.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.598 ' O ' ' HA ' ' A' ' 26' ' ' THR . 51.2 mt -91.69 110.74 23.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.121 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -75.35 154.9 37.01 Favored 'General case' 0 C--N 1.279 -2.461 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.462 ' CZ ' ' HG2' ' A' ' 13' ' ' LYS . 63.1 t80 -51.41 -51.62 67.27 Favored Pre-proline 0 C--N 1.311 -1.093 0 O-C-N 123.422 0.451 . . . . 0.0 111.668 176.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -49.98 -40.74 49.52 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.707 2.272 . . . . 0.0 112.397 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -69.6 -40.64 76.54 Favored 'General case' 0 C--O 1.22 -0.449 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.54 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 38.4 t80 -58.55 -40.49 83.17 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.205 0.602 . . . . 0.0 109.563 174.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 94.1 mt -64.94 -51.6 60.93 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.747 176.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 74.3 m -57.04 -45.87 82.84 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.826 0.45 . . . . 0.0 111.018 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.538 ' HB2' HG11 ' A' ' 55' ' ' VAL . 26.9 ttp -58.68 -44.09 90.15 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.49 0.716 . . . . 0.0 111.642 178.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.5 tpp -74.61 -36.3 62.95 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.153 -177.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.22 -48.57 80.86 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.269 177.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.493 ' HA ' ' HB3' ' A' ' 1' ' ' ALA . 82.9 mtp180 -70.12 -16.44 63.11 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.409 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.41 ' HD3' ' OE1' ' B' ' 90' ' ' GLN . 39.3 ttmt -88.82 -16.25 32.52 Favored 'General case' 0 C--N 1.297 -1.716 0 C-N-CA 123.032 0.533 . . . . 0.0 111.632 178.489 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.433 ' HE1' HD12 ' A' ' 4' ' ' LEU . 48.9 ttp -116.48 -64.36 1.32 Allowed 'General case' 0 C--O 1.244 0.812 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 -167.266 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.514 ' HG2' ' OE1' ' A' ' 3' ' ' GLN . 84.0 tttt -127.07 132.42 50.67 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -166.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 25.5 t70 80.7 10.47 1.04 Allowed 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 127.105 2.162 . . . . 0.0 106.231 -169.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 90.3 m -102.08 143.17 32.25 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 111.901 -2.409 . . . . 0.0 110.319 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.628 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 43.6 m-20 80.71 82.7 0.04 OUTLIER 'General case' 0 CA--C 1.496 -1.122 0 C-N-CA 124.646 1.178 . . . . 0.0 113.231 172.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.9 p -113.11 -60.96 1.81 Allowed 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -141.51 -58.09 0.48 Allowed 'General case' 0 N--CA 1.418 -2.031 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.134 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -68.85 -38.46 79.81 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.76 -173.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.628 ' HB2' ' HA ' ' A' ' 80' ' ' ASP . 42.8 mm-40 -56.76 -38.21 72.14 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.214 0.53 . . . . 0.0 110.058 175.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.489 HG21 HG12 ' A' ' 142' ' ' VAL . 15.0 mm -68.2 -46.83 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.693 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.5 ttm180 -71.02 -29.73 65.74 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 114.314 -1.312 . . . . 0.0 112.588 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -68.06 -44.47 76.27 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.504 0.669 . . . . 0.0 109.625 174.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.471 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -68.52 -24.29 64.63 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.741 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -81.46 -42.01 20.95 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 121.121 0.486 . . . . 0.0 109.903 176.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -57.39 -33.23 67.62 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.072 1.349 . . . . 0.0 112.612 -177.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.487 HG22 HG21 ' A' ' 108' ' ' VAL . 11.6 p -58.42 -31.08 42.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.255 178.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.507 ' HB3' HG23 ' A' ' 100' ' ' ILE . 61.2 m-85 -93.86 -60.93 1.64 Allowed 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -85.79 87.19 7.37 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 122.313 1.054 . . . . 0.0 110.149 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -78.51 -39.89 36.77 Favored 'General case' 0 C--N 1.288 -2.077 0 CA-C-N 113.399 -1.728 . . . . 0.0 111.259 -175.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -79.79 -13.15 59.63 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.919 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.87 50.88 5.35 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.309 -0.948 . . . . 0.0 110.921 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -97.9 -12.63 21.86 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-O 121.268 0.556 . . . . 0.0 109.835 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.403 ' O ' ' HA ' ' A' ' 137' ' ' ASN . . . 78.79 20.42 70.95 Favored Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.935 176.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.417 ' HA ' ' O ' ' A' ' 136' ' ' VAL . 21.8 p90 -150.52 154.89 38.43 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 117.037 0.418 . . . . 0.0 110.669 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.552 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.2 mt -110.65 137.62 42.27 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 177.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 14.8 m -116.69 154.72 30.09 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 123.973 0.796 . . . . 0.0 109.507 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.71 -44.15 82.43 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -175.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.68 -49.16 76.23 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.643 0.258 . . . . 0.0 110.945 -178.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -55.42 -46.62 76.65 Favored 'General case' 0 CA--C 1.501 -0.928 0 C-N-CA 123.164 0.586 . . . . 0.0 110.33 176.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.417 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.4 tt -59.16 -44.65 92.14 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-N 115.087 -0.96 . . . . 0.0 108.899 -173.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.666 ' HG3' HG21 ' A' ' 121' ' ' VAL . 33.0 mtp180 -62.29 -37.19 84.58 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 120.977 0.418 . . . . 0.0 111.805 174.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -60.96 -44.94 96.59 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.663 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.487 HG21 HG22 ' A' ' 91' ' ' VAL . 8.9 p -72.84 -31.39 36.09 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.213 0 C-N-CA 119.71 -0.796 . . . . 0.0 110.375 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.511 ' HG3' HD12 ' A' ' 116' ' ' LEU . 21.8 mmt -64.22 -44.73 90.98 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-O 120.57 0.224 . . . . 0.0 111.433 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 22.2 m -61.41 -33.55 73.88 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.245 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -75.21 -31.58 60.94 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.918 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.9 mt -81.88 -18.36 44.06 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.647 0.737 . . . . 0.0 109.904 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 86.09 21.93 50.62 Favored Glycine 0 N--CA 1.433 -1.552 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.54 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -101.6 122.28 43.56 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -83.16 107.88 16.03 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 123.475 0.484 . . . . 0.0 110.135 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.511 HD12 ' HG3' ' A' ' 109' ' ' MET . 20.8 mt -124.97 152.13 44.57 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 176.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 50.9 p -87.06 174.5 8.62 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -71.65 -30.09 65.35 Favored 'General case' 0 C--O 1.207 -1.134 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 175.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.9 -49.45 77.41 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.559 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -56.86 -55.22 37.22 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.166 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.666 HG21 ' HG3' ' A' ' 106' ' ' ARG . 11.3 m -68.5 -32.0 53.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.372 -175.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -67.42 -44.9 77.65 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -63.87 -39.7 94.81 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 123.472 0.483 . . . . 0.0 110.337 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.3 mtt -52.6 -54.16 36.81 Favored 'General case' 0 CA--C 1.499 -0.989 0 O-C-N 124.133 0.896 . . . . 0.0 110.452 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mm -65.39 -55.73 18.75 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.192 0 O-C-N 123.777 0.673 . . . . 0.0 110.448 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 50.7 ttt180 -49.06 -47.07 45.25 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 125.145 1.378 . . . . 0.0 113.989 -173.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.525 ' HB3' ' CZ ' ' B' ' 81' ' ' PHE . 7.9 tp10 -82.8 -27.2 31.11 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.665 -177.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.86 -19.96 47.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 122.309 1.052 . . . . 0.0 109.454 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 134' ' ' GLY . 9.5 t70 -73.23 74.51 1.3 Allowed 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.643 176.05 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.1 mt -75.89 -14.65 15.22 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 CA-C-N 114.342 -1.299 . . . . 0.0 107.922 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -81.66 -10.29 59.44 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.695 -1.139 . . . . 0.0 109.788 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 59.97 31.34 72.15 Favored Glycine 0 C--N 1.34 0.773 0 CA-C-N 115.013 -0.994 . . . . 0.0 113.757 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -115.42 -11.72 11.81 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 121.531 0.681 . . . . 0.0 111.15 -173.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.424 ' H ' ' CG ' ' A' ' 129' ' ' ASP . . . 94.81 14.78 48.34 Favored Glycine 0 C--N 1.304 -1.201 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -177.081 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -143.71 124.51 14.22 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.552 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.9 OUTLIER -88.79 112.86 24.62 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.88 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.988 179.203 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.403 ' HA ' ' O ' ' A' ' 98' ' ' GLY . 48.4 m-80 -81.84 160.99 23.37 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.939 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.441 ' O ' HG13 ' A' ' 142' ' ' VAL . 71.7 t80 -57.24 -42.36 81.3 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.692 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -62.22 -21.58 65.25 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -87.87 -44.91 10.72 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -62.97 -38.45 91.16 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.376 -1.284 . . . . 0.0 112.609 -177.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.489 HG12 HG21 ' A' ' 85' ' ' ILE . 25.5 m -57.14 -30.43 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-O 121.18 0.515 . . . . 0.0 111.982 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -79.28 -26.38 42.35 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 121.495 0.664 . . . . 0.0 111.178 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 85.5 mtp -80.06 -19.13 48.26 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.898 -175.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.438 ' HG2' ' CD1' ' A' ' 85' ' ' ILE . 58.4 tpp -62.98 -22.71 67.02 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -176.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 14.0 t -81.0 -2.97 50.08 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.196 -177.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -93.51 19.73 8.11 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 121.757 0.789 . . . . 0.0 110.119 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt . . . . . 0 C--N 1.302 -1.491 0 CA-C-N 113.579 -1.646 . . . . 0.0 112.838 -178.112 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.439 -1.02 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.54 -29.11 77.34 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 122.94 2.427 . . . . 0.0 112.813 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.08 22.0 2.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.882 -178.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 38.6 p30 -66.37 -18.74 65.54 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 19.1 m -90.36 15.84 9.85 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-O 121.099 0.476 . . . . 0.0 109.932 176.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 49.59 -87.98 0.01 OUTLIER 'General case' 0 C--O 1.246 0.907 0 C-N-CA 126.413 1.885 . . . . 0.0 115.132 174.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -65.65 -24.47 67.03 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 122.584 0.354 . . . . 0.0 111.455 -175.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 81' ' ' PHE . . . . . 0.525 ' CZ ' ' HB3' ' A' ' 127' ' ' GLU . 72.8 t80 -53.02 -38.72 62.59 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.66 0.784 . . . . 0.0 111.304 176.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 82' ' ' LYS . . . . . 0.504 ' HE3' ' OE1' ' B' ' 83' ' ' GLU . 2.9 tmmm? -71.61 -49.99 35.09 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 83' ' ' GLU . . . . . 0.504 ' OE1' ' HE3' ' B' ' 82' ' ' LYS . 11.9 mm-40 -65.9 -26.85 67.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.521 0.201 . . . . 0.0 111.326 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.72 -56.07 26.46 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 172.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.491 ' O ' HG12 ' B' ' 89' ' ' ILE . 60.4 m95 -61.51 -42.55 98.98 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.186 176.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 86' ' ' LYS . . . . . 0.403 ' HG2' ' OE1' ' B' ' 83' ' ' GLU . 19.0 tptm -49.0 -55.18 12.72 Favored 'General case' 0 CA--C 1.501 -0.904 0 C-N-CA 125.424 1.49 . . . . 0.0 110.057 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -63.42 -46.43 86.39 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.305 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.16 -52.52 65.35 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 123.538 0.524 . . . . 0.0 112.387 -177.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.491 HG12 ' O ' ' B' ' 85' ' ' TRP . 29.3 pt -68.92 -29.18 42.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.129 0.49 . . . . 0.0 111.225 -177.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 90' ' ' GLN . . . . . 0.485 ' OE1' ' HA ' ' B' ' 96' ' ' PRO . 8.2 tt0 -78.25 -42.77 30.1 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.652 -179.084 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 12.0 tppt? -55.28 -37.65 67.58 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.063 1.345 . . . . 0.0 109.235 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.428 ' HB2' HG11 ' A' ' 91' ' ' VAL . . . -63.43 -31.49 72.66 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.54 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -86.55 -53.88 4.72 Favored 'General case' 0 N--CA 1.433 -1.308 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -161.04 179.75 8.18 Favored 'General case' 0 C--O 1.208 -1.094 0 C-N-CA 124.349 1.06 . . . . 0.0 108.484 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.629 ' SD ' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -64.62 122.01 76.26 Favored Pre-proline 0 C--N 1.291 -1.937 0 CA-C-O 121.242 0.544 . . . . 0.0 111.91 179.705 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.485 ' HA ' ' OE1' ' B' ' 90' ' ' GLN . 60.5 Cg_endo -93.45 -4.9 2.92 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 124.138 3.225 . . . . 0.0 113.315 -177.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 97' ' ' ASP . . . . . 0.563 ' HB2' ' HD3' ' B' ' 98' ' ' PRO . 5.8 m-20 -86.44 -48.57 0.52 Allowed Pre-proline 0 C--N 1.288 -2.099 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.774 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 98' ' ' PRO . . . . . 0.563 ' HD3' ' HB2' ' B' ' 97' ' ' ASP . 17.2 Cg_exo -77.77 52.37 3.95 Favored 'Trans proline' 0 C--N 1.371 1.715 0 C-N-CA 122.439 2.093 . . . . 0.0 110.18 169.047 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 68.1 t90 -87.67 -34.31 18.48 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.41 -2.451 0 N-CA-C 105.485 -2.042 . . . . 0.0 105.485 -176.487 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.497 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -129.4 -4.42 4.84 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.9 0.857 . . . . 0.0 108.838 171.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -113.63 123.56 50.23 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.454 ' HB3' HD11 ' A' ' 9' ' ' ILE . 11.4 tp -96.42 159.77 14.76 Favored 'General case' 0 C--N 1.291 -1.956 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.52 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.48 ' O ' HG13 ' A' ' 9' ' ' ILE . 34.5 p -86.76 143.52 27.48 Favored 'General case' 0 N--CA 1.42 -1.929 0 C-N-CA 123.214 0.606 . . . . 0.0 110.811 -177.047 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -52.19 -46.76 65.68 Favored 'General case' 0 C--O 1.244 0.786 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -174.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -60.32 -46.32 90.29 Favored 'General case' 0 CA--C 1.512 -0.488 0 O-C-N 123.269 0.356 . . . . 0.0 110.548 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.408 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 23.0 tp60 -66.13 -37.84 86.7 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.659 -178.051 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.503 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 30.5 mt -63.5 -43.01 98.17 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.0 177.324 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.79 -41.83 91.47 Favored 'General case' 0 C--O 1.259 1.584 0 CA-C-O 121.399 0.618 . . . . 0.0 110.935 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -60.68 -43.82 97.25 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.126 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.416 ' CZ ' ' HG3' ' A' ' 72' ' ' MET . 19.4 m-85 -62.92 -40.83 98.8 Favored 'General case' 0 C--O 1.168 -3.234 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.984 175.623 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -47.99 -52.54 19.41 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.388 0.613 . . . . 0.0 111.987 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -66.75 -48.14 70.02 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.0 -177.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.05 -31.53 69.19 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.434 0.635 . . . . 0.0 111.902 -177.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -65.41 -40.3 93.21 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 124.591 1.156 . . . . 0.0 109.702 177.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 26.1 m -69.87 -25.51 63.75 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.066 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -70.89 -43.19 68.86 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.402 ' CZ ' ' HA ' ' B' ' 100' ' ' ALA . 3.6 m-85 -66.04 -43.05 88.65 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.339 178.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -69.76 101.27 1.66 Allowed 'General case' 0 C--N 1.313 -1.017 0 O-C-N 123.947 0.779 . . . . 0.0 109.848 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -77.19 1.92 16.98 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -109.44 -13.78 14.53 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 175.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.39 24.54 73.67 Favored Glycine 0 N--CA 1.437 -1.234 0 CA-C-N 114.608 -1.178 . . . . 0.0 112.164 -176.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -98.95 -18.54 17.78 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 119.572 -0.851 . . . . 0.0 112.205 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.25 29.73 7.77 Favored Glycine 0 C--N 1.307 -1.033 0 C-N-CA 120.677 -0.773 . . . . 0.0 114.603 175.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.8 p -145.43 129.86 17.81 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 173.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 51.6 mt -101.7 115.45 43.51 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.987 -177.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.9 p -84.66 178.01 7.83 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.522 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.7 p -64.83 -29.25 70.2 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.475 0.655 . . . . 0.0 109.55 176.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -59.23 -57.85 11.2 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.772 177.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -64.48 -39.4 93.73 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 114.265 -1.334 . . . . 0.0 111.093 -177.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.423 ' HB3' ' HE3' ' A' ' 36' ' ' MET . 56.5 mt -56.17 -57.5 11.91 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 123.373 0.421 . . . . 0.0 110.548 175.07 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.72 -31.31 79.66 Favored Glycine 0 C--O 1.211 -1.285 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.366 -178.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.9 m -69.13 -46.99 66.26 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 116.839 0.32 . . . . 0.0 110.825 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 28.4 m -70.69 -28.64 34.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 121.306 0.575 . . . . 0.0 110.755 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.532 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 22.2 mtt -68.81 -40.81 79.35 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 173.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -66.35 -30.57 71.0 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 123.851 0.86 . . . . 0.0 110.891 178.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.7 m -64.53 -25.95 68.21 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.462 0.649 . . . . 0.0 110.132 176.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -106.34 13.92 28.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.023 178.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.1 34.65 41.01 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 115.386 0.914 . . . . 0.0 115.386 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.459 ' C ' HD22 ' A' ' 42' ' ' ASN . 4.8 tt0 -131.22 129.84 42.15 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 118.295 1.047 . . . . 0.0 109.853 176.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.459 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.82 86.02 45.36 Favored Pre-proline 0 C--N 1.305 -1.347 0 O-C-N 122.126 -0.359 . . . . 0.0 110.489 176.75 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.532 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 16.6 Cg_exo -70.02 163.62 37.82 Favored 'Trans proline' 0 C--O 1.246 0.905 0 C-N-CA 122.992 2.461 . . . . 0.0 111.96 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.505 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 44.0 p -73.85 142.96 46.06 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 174.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -72.13 -19.08 61.84 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.034 -174.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.83 -39.72 92.8 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.095 174.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.505 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 37.8 mm-40 -65.14 -42.54 93.71 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 69.9 mt -65.89 -40.55 91.65 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.82 -1.082 . . . . 0.0 112.983 -175.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 64.4 tp60 -63.29 -44.96 93.56 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.82 177.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -64.16 -38.04 89.61 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.984 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 38.4 tpp -60.11 -50.89 71.91 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.977 -1.011 . . . . 0.0 109.798 178.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.8 mt -60.79 -51.79 69.1 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.483 177.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.407 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 12.2 t30 -63.92 -13.4 45.29 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -173.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -72.28 -40.99 67.2 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.599 HG11 ' HB2' ' A' ' 71' ' ' MET . 22.0 m -97.24 -21.98 5.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.211 -176.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 34.9 t0 -72.36 112.08 8.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.299 -179.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.51 -27.12 24.2 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-O 121.194 0.521 . . . . 0.0 110.914 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.33 -11.81 31.5 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -174.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.52 58.68 12.67 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.414 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -102.88 -16.83 15.77 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.2 23.35 34.91 Favored Glycine 0 N--CA 1.419 -2.451 0 N-CA-C 108.83 -1.708 . . . . 0.0 108.83 -173.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 49.4 p -140.35 137.13 33.84 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-N 115.567 -0.316 . . . . 0.0 111.039 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 57.5 mt -91.03 104.77 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.538 0 N-CA-C 104.269 -2.493 . . . . 0.0 104.269 173.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -84.0 168.17 16.2 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.553 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 57.8 t80 -52.87 -56.01 27.61 Favored Pre-proline 0 CA--C 1.554 1.128 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -175.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.75 -39.79 75.95 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 122.621 2.214 . . . . 0.0 112.547 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -70.38 -37.6 74.57 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.309 0.576 . . . . 0.0 110.056 -177.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -62.76 -41.97 99.47 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 72.2 mt -62.24 -49.28 76.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.014 178.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.1 m -56.87 -42.8 80.44 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.356 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.599 ' HB2' HG11 ' A' ' 55' ' ' VAL . 32.1 ttp -58.76 -46.68 86.9 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.165 0.586 . . . . 0.0 111.689 178.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.416 ' HG3' ' CZ ' ' A' ' 12' ' ' PHE . 23.2 mmt -71.76 -37.39 70.5 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.716 -177.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.31 -43.19 99.4 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -63.39 -28.94 70.33 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.69 176.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.435 ' HZ1' ' CG ' ' B' ' 97' ' ' ASP . 40.2 ttmt -69.01 -38.3 79.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 62.9 mtt -69.42 -47.96 62.5 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.51 179.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 87.3 tttt 68.44 -28.04 0.15 Allowed 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 174.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 82.09 12.69 0.59 Allowed 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 126.264 1.826 . . . . 0.0 109.219 -172.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.9 m -139.17 37.59 2.11 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -80.77 -36.22 32.15 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.202 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.7 m -69.47 125.51 26.93 Favored 'General case' 0 N--CA 1.427 -1.599 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.46 -172.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 70.76 -48.65 0.66 Allowed 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 125.564 1.546 . . . . 0.0 112.949 -177.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -66.33 -50.11 64.71 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 120.839 0.352 . . . . 0.0 111.668 -172.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -84.68 -26.0 28.04 Favored 'General case' 0 CA--C 1.494 -1.186 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.991 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.404 HD12 ' HG2' ' A' ' 145' ' ' MET . 4.9 mm -72.79 -36.69 53.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.733 -175.051 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -73.13 -30.94 63.97 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 176.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -67.99 -46.18 72.01 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.93 -27.91 69.17 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.024 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -76.55 -46.3 26.96 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -57.48 -38.7 74.97 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.529 1.132 . . . . 0.0 111.43 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.594 ' O ' ' HE2' ' A' ' 94' ' ' LYS . 11.6 p -68.06 -19.85 25.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.754 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -96.19 -52.39 4.03 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.742 177.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -80.46 100.94 8.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.576 0.703 . . . . 0.0 111.073 -178.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.594 ' HE2' ' O ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -78.52 -24.04 45.97 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.487 -0.779 . . . . 0.0 113.081 -179.424 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.91 -13.89 52.37 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.556 -0.858 . . . . 0.0 110.523 -176.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.28 43.26 95.49 Favored Glycine 0 CA--C 1.499 -0.924 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 178.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -101.61 -19.27 15.52 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 120.951 0.405 . . . . 0.0 110.603 -174.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.96 11.52 60.1 Favored Glycine 0 C--N 1.314 -0.684 0 C-N-CA 119.517 -1.325 . . . . 0.0 111.366 -179.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.418 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 51.9 m-85 -140.93 130.74 24.31 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.426 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.0 mt -103.59 133.74 46.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.8 t -100.95 158.94 15.62 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.88 -42.56 76.83 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 177.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.18 -33.52 75.65 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.772 177.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.511 ' O ' ' HB3' ' A' ' 107' ' ' HIS . 4.2 tp10 -65.52 -49.44 68.98 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 174.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.552 ' O ' ' HG2' ' A' ' 109' ' ' MET . 22.0 mt -56.52 -48.23 77.66 Favored 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.4 -176.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.403 ' HB2' HG21 ' A' ' 121' ' ' VAL . 2.1 tmm_? -56.1 -43.96 78.57 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.511 ' HB3' ' O ' ' A' ' 104' ' ' GLU . 6.8 t-80 -52.87 -55.71 21.15 Favored 'General case' 0 C--O 1.254 1.316 0 C-N-CA 123.996 0.918 . . . . 0.0 111.365 176.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.461 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.6 p -73.24 -33.51 41.64 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.641 0 C-N-CA 120.243 -0.583 . . . . 0.0 111.494 -176.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.552 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.2 mmt -64.87 -43.71 92.05 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 122.432 0.293 . . . . 0.0 111.279 -178.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.6 m -62.04 -35.5 78.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -73.04 -27.21 61.62 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.113 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 78.0 mt -89.14 -21.18 23.47 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.03 -0.419 . . . . 0.0 111.73 -177.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.51 20.27 13.81 Favored Glycine 0 C--N 1.312 -0.794 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.21 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.495 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 1.4 mp0 -100.32 110.68 22.91 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 123.476 0.71 . . . . 0.0 109.779 178.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -82.03 69.63 8.78 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 122.236 1.017 . . . . 0.0 111.591 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.607 HD13 ' SD ' ' A' ' 124' ' ' MET . 56.6 mt -101.85 139.32 37.65 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 177.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 40.2 p -84.58 171.33 12.55 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.38 -31.89 73.17 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -66.15 -51.21 60.05 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.813 177.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.556 ' O ' ' HG3' ' A' ' 124' ' ' MET . 29.0 tt0 -66.56 -42.87 86.41 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.877 -176.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.53 ' HA ' ' SD ' ' A' ' 124' ' ' MET . 23.1 m -66.12 -31.36 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 120.429 -0.509 . . . . 0.0 111.169 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -68.06 -38.86 82.92 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.484 0.659 . . . . 0.0 109.702 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -66.38 -32.41 73.77 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.335 175.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.607 ' SD ' HD13 ' A' ' 116' ' ' LEU . 92.6 mtp -63.58 -45.01 92.38 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 174.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.3 mm -57.58 -50.25 77.89 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.144 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.246 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 126' ' ' ARG . 15.2 ttp180 -59.28 -25.01 63.73 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 124' ' ' MET . 30.2 mm-40 -65.83 -48.88 70.16 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.974 0.416 . . . . 0.0 111.448 173.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -91.81 -23.45 19.7 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -173.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.498 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 30.2 t70 -72.8 96.28 2.04 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 176.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.0 mt -83.53 -53.08 12.1 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.559 -176.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -79.6 -9.66 59.66 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -173.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.498 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 81.37 55.91 3.12 Favored Glycine 0 C--N 1.307 -1.041 0 C-N-CA 120.746 -0.74 . . . . 0.0 113.482 173.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -104.37 -16.18 15.2 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 98.0 -5.01 61.25 Favored Glycine 0 CA--C 1.494 -1.247 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.418 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 80.3 mt-30 -143.59 127.08 16.88 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.426 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.7 OUTLIER -76.05 128.43 37.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 123.795 0.684 . . . . 0.0 112.769 -176.141 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.2 m-80 -83.83 162.28 20.63 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.429 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -64.89 -39.06 92.94 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.73 -21.7 63.44 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.552 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -88.18 -39.92 14.12 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -62.88 -42.83 99.91 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.835 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 27.6 m -62.07 -30.83 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-O 121.077 0.465 . . . . 0.0 111.132 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -48.88 31.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 25.7 ttt -60.54 -42.18 95.99 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.996 0.427 . . . . 0.0 110.765 178.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.404 ' HG2' HD12 ' A' ' 85' ' ' ILE . 41.2 tpp -60.54 -27.26 67.52 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.742 0.817 . . . . 0.0 112.362 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 12.4 p -104.38 2.63 31.47 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.035 0.445 . . . . 0.0 111.404 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -92.55 91.28 7.51 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 121.262 0.553 . . . . 0.0 111.552 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 51.6 mtpt . . . . . 0 C--N 1.31 -1.134 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 176.005 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 45.9 t . . . . . 0 N--CA 1.438 -1.037 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -80.23 -13.47 12.47 Favored 'Trans proline' 0 N--CA 1.447 -1.234 0 C-N-CA 121.824 1.683 . . . . 0.0 111.122 175.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . 67.48 -52.76 0.49 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.824 1.65 . . . . 0.0 113.006 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -134.57 116.87 15.53 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 15.1 m -105.82 22.26 15.89 Favored 'General case' 0 C--N 1.291 -1.96 0 CA-C-O 120.999 0.428 . . . . 0.0 110.375 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -126.23 78.02 1.73 Allowed 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 112.179 0.436 . . . . 0.0 112.179 -172.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 80' ' ' HIS . . . . . 0.423 ' HA ' ' HB2' ' B' ' 83' ' ' GLU . 33.8 m80 63.85 -34.9 0.15 Allowed 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 174.495 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -67.65 -57.33 6.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 118.866 0.757 . . . . 0.0 111.378 -176.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -67.76 -32.94 73.87 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.657 0.741 . . . . 0.0 109.165 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 83' ' ' GLU . . . . . 0.423 ' HB2' ' HA ' ' B' ' 80' ' ' HIS . 38.8 mt-10 -69.28 -26.26 64.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.689 -176.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.13 95.5 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.571 ' O ' HG12 ' B' ' 89' ' ' ILE . 86.0 m95 -65.75 -48.56 71.44 Favored 'General case' 0 CA--C 1.496 -1.097 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.063 176.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -55.93 -45.14 78.85 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 124.003 0.814 . . . . 0.0 110.771 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 27.0 m80 -61.72 -56.93 14.38 Favored 'General case' 0 C--O 1.206 -1.204 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.033 176.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.43 -51.85 63.64 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.635 ' O ' ' HE3' ' B' ' 93' ' ' LYS . 37.8 pt -62.57 -43.3 98.32 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.164 -177.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 90' ' ' GLN . . . . . 0.413 ' HG3' HG13 ' B' ' 89' ' ' ILE . 27.6 mt-30 -71.78 -42.98 66.48 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.0 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.507 ' CD ' ' HD3' ' B' ' 96' ' ' PRO . 21.4 tptm -56.37 -44.49 80.2 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 125.035 1.334 . . . . 0.0 111.587 178.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.532 ' HB1' HG21 ' A' ' 91' ' ' VAL . . . -63.22 -32.93 74.46 Favored 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.637 -178.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.635 ' HE3' ' O ' ' B' ' 89' ' ' ILE . 8.5 mtmp? -99.67 -11.26 21.06 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -174.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -164.25 117.06 1.36 Allowed 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 -175.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -58.61 147.82 68.87 Favored Pre-proline 0 CA--C 1.492 -1.263 0 CA-C-O 117.853 -1.07 . . . . 0.0 108.717 -174.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.507 ' HD3' ' CD ' ' B' ' 91' ' ' LYS . 36.1 Cg_exo 2.92 73.68 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.111 1 C-N-CA 125.836 4.357 . . . . 0.0 114.347 -162.508 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 97' ' ' ASP . . . . . 0.435 ' CG ' ' HZ1' ' A' ' 75' ' ' LYS . 15.2 t70 -53.14 110.38 1.97 Allowed Pre-proline 0 C--O 1.241 0.626 0 CA-C-N 113.003 -1.908 . . . . 0.0 111.16 -173.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -73.93 93.98 0.88 Allowed 'Trans proline' 0 N--CA 1.442 -1.531 0 C-N-CA 122.247 1.965 . . . . 0.0 109.599 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 99' ' ' TRP . . . . . 0.427 ' HB2' ' OD1' ' B' ' 97' ' ' ASP . 42.9 t90 -126.47 116.57 21.33 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -175.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 100' ' ' ALA . . . . . 0.402 ' HA ' ' CZ ' ' A' ' 19' ' ' PHE . . . . . . . . 0 C--N 1.282 -2.343 0 O-C-N 124.15 0.906 . . . . 0.0 109.356 -176.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.674 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -133.08 -18.48 2.31 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 120.682 0.277 . . . . 0.0 110.649 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.0 mm-40 -80.23 131.54 35.71 Favored 'General case' 0 C--O 1.248 1.024 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.41 ' HB3' HD11 ' A' ' 9' ' ' ILE . 12.8 tp -132.39 165.97 23.04 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 -176.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.7 p -90.12 143.82 26.44 Favored 'General case' 0 C--N 1.303 -1.42 0 C-N-CA 122.877 0.471 . . . . 0.0 111.718 -178.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 2.4 mp0 -46.54 -55.12 8.06 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 125.606 1.562 . . . . 0.0 113.342 -175.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -61.39 -40.8 95.68 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.188 0.595 . . . . 0.0 111.074 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.44 ' O ' ' HD2' ' A' ' 12' ' ' PHE . 6.3 tp-100 -65.81 -41.65 91.61 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.494 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 69.4 mt -63.33 -35.61 72.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.556 177.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.92 -39.12 87.29 Favored 'General case' 0 C--O 1.257 1.449 0 CA-C-O 121.093 0.473 . . . . 0.0 110.576 177.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -60.22 -48.38 81.98 Favored 'General case' 0 C--O 1.247 0.945 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 175.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.44 ' HD2' ' O ' ' A' ' 8' ' ' GLN . 28.2 m-85 -56.6 -46.52 80.82 Favored 'General case' 0 C--O 1.184 -2.393 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.727 175.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 33.9 mmtp -46.82 -49.83 19.38 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.501 0.721 . . . . 0.0 112.073 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -65.51 -57.27 8.64 Favored 'General case' 0 C--O 1.255 1.379 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.074 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.519 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -68.15 -28.54 67.39 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.806 -175.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.8 -42.58 99.19 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 123.176 0.59 . . . . 0.0 109.78 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.4 m -72.59 -18.23 61.62 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.111 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.519 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 62.8 tp -68.9 -42.18 77.23 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.099 0.475 . . . . 0.0 110.198 172.705 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -78.95 -35.97 42.37 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.143 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -77.17 99.32 5.38 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.683 175.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -74.42 -3.08 28.4 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.331 -0.85 . . . . 0.0 113.277 -174.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.415 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 21.6 m-20 -110.95 -13.26 14.14 Favored 'General case' 0 CA--C 1.49 -1.363 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.729 -179.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.41 23.18 68.23 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 -176.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.415 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 3.9 p-10 -97.25 -16.36 20.39 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.891 0.377 . . . . 0.0 110.044 -173.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 101.98 8.35 45.17 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 114.851 0.701 . . . . 0.0 114.851 176.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.4 p -130.53 136.55 49.05 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 118.471 1.136 . . . . 0.0 109.628 177.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.1 mt -102.89 114.64 43.05 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 176.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.0 p -87.12 172.24 10.1 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.469 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.8 p -65.79 -32.83 74.58 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.128 0.489 . . . . 0.0 110.218 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -62.43 -45.95 90.76 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.589 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -66.6 -41.65 88.09 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.74 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.475 HD22 ' HB3' ' B' ' 96' ' ' PRO . 89.7 mt -55.64 -62.1 1.91 Allowed 'General case' 0 CA--C 1.501 -0.929 0 O-C-N 124.006 0.816 . . . . 0.0 109.874 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -59.4 -29.12 65.75 Favored Glycine 0 C--O 1.2 -1.974 0 C-N-CA 121.18 -0.533 . . . . 0.0 113.422 -175.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.1 m -73.61 -46.2 48.4 Favored 'General case' 0 CA--C 1.554 1.128 0 CA-C-N 117.606 0.703 . . . . 0.0 111.354 178.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.97 -28.21 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 121.771 0.796 . . . . 0.0 109.97 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.692 ' SD ' ' HA ' ' B' ' 96' ' ' PRO . 48.3 mtp -77.68 -28.73 51.16 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.344 177.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 80.3 ttt180 -68.57 -29.08 67.55 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 176.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.0 m -65.2 -35.45 81.1 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.157 173.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -82.65 -22.44 34.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.142 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.74 25.02 5.59 Favored Glycine 0 N--CA 1.435 -1.414 0 C-N-CA 120.816 -0.706 . . . . 0.0 114.236 178.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.417 ' HG2' ' HD3' ' A' ' 43' ' ' PRO . 42.7 tt0 -139.53 122.6 16.8 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 118.105 0.953 . . . . 0.0 109.476 176.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -141.11 89.85 9.52 Favored Pre-proline 0 C--N 1.298 -1.64 0 CA-C-O 121.71 0.766 . . . . 0.0 111.334 174.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.417 ' HD3' ' HG2' ' A' ' 41' ' ' GLN . 22.2 Cg_endo -75.95 172.42 16.31 Favored 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.785 2.324 . . . . 0.0 112.126 178.204 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 p -73.07 164.33 26.85 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.941 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -52.76 -46.81 67.67 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.802 1.241 . . . . 0.0 111.095 -176.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.46 -43.4 83.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.289 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -64.19 -43.14 95.97 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.25 0.548 . . . . 0.0 110.546 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.2 mt -68.55 -47.08 67.77 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.76 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -58.67 -46.1 87.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.47 0.653 . . . . 0.0 109.531 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -62.57 -30.86 71.63 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.6 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 34.9 tpp -83.04 -39.51 21.14 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.9 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.406 HG22 ' HB2' ' A' ' 56' ' ' ASP . 42.4 mt -57.74 -42.98 83.0 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 176.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -56.05 -18.42 9.54 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 124.272 1.029 . . . . 0.0 113.546 -177.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -70.14 -43.76 70.25 Favored 'General case' 0 N--CA 1.393 -3.323 0 O-C-N 121.667 -0.646 . . . . 0.0 110.717 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.575 HG11 ' HB2' ' A' ' 71' ' ' MET . 12.2 m -95.29 -25.29 4.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.202 0.525 . . . . 0.0 110.095 -177.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.406 ' HB2' HG22 ' A' ' 52' ' ' ILE . 25.9 t0 -67.86 115.94 7.96 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.776 -176.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.12 -27.99 57.29 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.155 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -94.55 -12.45 27.55 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -174.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.03 37.56 63.36 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -173.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.5 p-10 -104.04 -7.58 20.19 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -171.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.78 23.18 11.08 Favored Glycine 0 C--N 1.307 -1.052 0 C-N-CA 120.195 -1.002 . . . . 0.0 113.818 172.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.55 132.66 21.61 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 116.819 0.31 . . . . 0.0 110.484 177.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 52.6 mt -92.39 110.05 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 176.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -85.34 178.43 7.47 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.401 ' CE2' HD11 ' A' ' 69' ' ' LEU . 67.1 t80 -63.07 -54.79 43.04 Favored Pre-proline 0 C--N 1.298 -1.649 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -174.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -52.11 -40.05 69.38 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.616 2.21 . . . . 0.0 112.654 175.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -66.12 -40.85 90.99 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.4 0.619 . . . . 0.0 109.795 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.524 ' CZ ' ' HB3' ' B' ' 100' ' ' ALA . 5.3 t80 -64.18 -40.88 97.05 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.94 177.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.401 HD11 ' CE2' ' A' ' 65' ' ' PHE . 81.1 mt -61.05 -48.45 81.68 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.56 176.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.6 m -56.92 -44.66 82.65 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 123.427 0.454 . . . . 0.0 110.257 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.575 ' HB2' HG11 ' A' ' 55' ' ' VAL . 30.5 ttp -56.99 -44.68 82.98 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.4 mmt -85.8 -32.54 21.73 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 119.086 -1.046 . . . . 0.0 112.52 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.26 -40.42 97.37 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 74' ' ' ARG . 2.5 ptm180 -66.07 -26.21 67.39 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 121.848 0.832 . . . . 0.0 110.364 178.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -87.28 -28.99 21.97 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 114.626 -1.17 . . . . 0.0 109.389 -176.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.3 ttm -76.47 -67.06 0.73 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.53 -1.213 . . . . 0.0 111.479 -177.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -100.39 90.68 4.39 Favored 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -174.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 54.65 99.43 0.01 OUTLIER 'General case' 0 CA--C 1.49 -1.333 0 O-C-N 124.806 1.316 . . . . 0.0 114.092 175.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.7 t -83.01 61.54 6.06 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-O 122.427 1.108 . . . . 0.0 109.157 174.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -81.32 80.79 7.66 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 122.531 1.157 . . . . 0.0 108.147 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 50.3 m -175.53 -28.86 0.01 OUTLIER 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 104.421 -2.437 . . . . 0.0 104.421 -173.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.44 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 2.1 mp0 63.48 23.55 13.71 Favored 'General case' 0 C--N 1.36 1.042 0 CA-C-N 113.595 -1.639 . . . . 0.0 112.197 175.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 45.0 mt-10 -65.06 -59.56 4.0 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -52.93 -39.75 63.09 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.257 1.027 . . . . 0.0 109.496 176.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.4 mm -67.63 -51.26 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-N 113.376 -1.738 . . . . 0.0 110.354 -173.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 42.8 ttm105 -71.92 -30.99 65.92 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.338 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 47.6 mt-10 -61.28 -44.77 96.67 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.501 0.667 . . . . 0.0 110.181 174.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.46 -34.17 75.47 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.347 178.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -66.89 -50.32 62.84 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.946 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -66.43 -19.72 65.87 Favored 'General case' 0 N--CA 1.419 -1.998 0 C-N-CA 123.454 0.702 . . . . 0.0 112.767 -176.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.4 p -83.15 -28.72 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 C-N-CA 118.724 -1.191 . . . . 0.0 111.006 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -83.52 -48.19 10.54 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 177.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -75.87 105.33 6.85 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 175.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -77.88 -16.98 57.84 Favored 'General case' 0 C--N 1.288 -2.093 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -169.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -115.01 -13.06 11.91 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 120.262 -0.575 . . . . 0.0 111.939 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.83 55.75 5.22 Favored Glycine 0 N--CA 1.437 -1.262 0 N-CA-C 108.327 -1.909 . . . . 0.0 108.327 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -100.69 -18.47 16.51 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.065 0.46 . . . . 0.0 110.44 -174.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.64 11.99 59.99 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.256 -1.137 . . . . 0.0 110.256 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -147.46 130.59 16.4 Favored 'General case' 0 CA--C 1.498 -1.024 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -176.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.47 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.4 mt -104.74 132.63 50.99 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 175.298 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.3 p -109.82 160.09 16.65 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.481 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.84 -46.34 82.35 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -175.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.5 98.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.181 0.515 . . . . 0.0 109.87 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -61.62 -40.13 93.77 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.518 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 121' ' ' VAL . 4.0 tt -61.56 -43.55 98.65 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.594 ' HG3' HG21 ' A' ' 121' ' ' VAL . 31.0 mtm180 -60.89 -40.49 93.22 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 121.249 -0.181 . . . . 0.0 111.473 174.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -57.24 -50.82 71.68 Favored 'General case' 0 C--O 1.244 0.802 0 O-C-N 123.174 0.297 . . . . 0.0 111.523 178.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.2 p -68.6 -34.42 65.1 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 C-N-CA 119.819 -0.753 . . . . 0.0 110.06 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.458 ' HG3' HD12 ' A' ' 116' ' ' LEU . 23.3 mmt -65.7 -36.28 83.17 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 58.3 m -63.08 -36.9 85.13 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -69.12 -35.01 75.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.267 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 80.0 mt -87.5 -20.49 26.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -172.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 71.07 32.21 66.05 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 116.335 -0.393 . . . . 0.0 112.279 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -81.14 -25.12 37.13 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -178.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt 69.55 71.92 0.24 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.887 0.875 . . . . 0.0 111.0 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.458 HD12 ' HG3' ' A' ' 109' ' ' MET . 32.6 mt -118.61 130.58 55.96 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 37.8 p -83.47 174.09 10.92 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.909 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -57.12 -44.16 83.04 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 122.939 0.496 . . . . 0.0 111.013 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -55.57 -44.65 77.08 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 123.765 0.666 . . . . 0.0 111.251 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -69.52 -48.91 58.96 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.824 -175.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.594 HG21 ' HG3' ' A' ' 106' ' ' ARG . 7.3 m -67.88 -34.23 66.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.314 -177.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -69.87 -40.13 75.92 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.229 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 11.1 tp10 -65.62 -42.14 91.91 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 54.1 mtt -57.3 -50.91 71.43 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.65 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 121' ' ' VAL . 42.8 mm -56.01 -47.16 80.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -63.05 -29.97 71.23 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 123' ' ' GLU . 49.1 mt-10 -70.49 -42.42 71.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.016 0.436 . . . . 0.0 110.296 177.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.429 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -81.55 -33.38 31.74 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.22 -0.446 . . . . 0.0 112.01 -176.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -68.37 107.3 2.8 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 123.894 0.878 . . . . 0.0 109.975 177.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 68.9 mt -82.54 -42.41 18.38 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.752 -177.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -76.02 -11.79 60.01 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.007 0.432 . . . . 0.0 112.046 -174.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 68.84 46.98 58.15 Favored Glycine 0 N--CA 1.44 -1.063 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -99.61 -16.18 18.32 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 121.412 0.625 . . . . 0.0 110.51 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.22 -4.2 58.54 Favored Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.989 -0.624 . . . . 0.0 111.742 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -135.76 142.44 44.96 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.47 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.6 OUTLIER -100.28 126.57 53.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 O-C-N 123.595 0.559 . . . . 0.0 111.086 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -85.22 169.02 14.22 Favored 'General case' 0 CA--C 1.501 -0.908 0 O-C-N 123.679 0.612 . . . . 0.0 110.57 177.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.538 ' O ' HG13 ' A' ' 142' ' ' VAL . 92.0 t80 -60.14 -45.46 92.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.302 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.43 ' O ' HG22 ' A' ' 142' ' ' VAL . 4.1 mp0 -62.46 -29.95 70.9 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.695 0.798 . . . . 0.0 111.276 -179.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 47.4 mt-10 -82.57 -35.71 26.89 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.198 0.523 . . . . 0.0 109.736 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -69.4 -39.36 77.99 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.341 178.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.538 HG13 ' O ' ' A' ' 138' ' ' TYR . 19.5 m -58.58 -34.79 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-O 120.701 0.286 . . . . 0.0 110.524 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.6 tm0? -59.92 -40.86 90.3 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.364 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 70.2 mtp -86.38 -36.08 19.41 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 17.2 tpt -60.37 -40.28 90.26 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.625 -177.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' THR . . . . . 0.497 HG22 ' O ' ' A' ' 142' ' ' VAL . 14.5 t -94.72 11.99 29.38 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.753 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -96.53 173.91 7.11 Favored 'General case' 0 C--O 1.244 0.776 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 23.8 pttm . . . . . 0 C--N 1.303 -1.44 0 CA-C-O 119.192 -0.433 . . . . 0.0 109.919 178.837 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 45.8 t . . . . . 0 C--O 1.243 0.721 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -55.47 -52.14 8.34 Favored 'Trans proline' 0 C--N 1.359 1.101 0 C-N-CA 123.226 2.617 . . . . 0.0 111.344 176.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.26 133.04 34.15 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -60.5 -36.89 79.42 Favored 'General case' 0 C--N 1.31 -1.127 0 O-C-N 123.473 0.483 . . . . 0.0 112.232 -175.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 15.0 m -89.19 -17.84 28.32 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.113 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 53.3 t80 61.21 99.19 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.191 0.996 . . . . 0.0 108.847 -172.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 15.9 t60 171.82 -38.16 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -172.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -82.99 -48.3 10.8 Favored 'General case' 0 C--O 1.206 -1.187 0 N-CA-C 115.582 1.697 . . . . 0.0 115.582 -171.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -59.8 -38.34 81.64 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-O 122.36 1.076 . . . . 0.0 109.14 178.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 83' ' ' GLU . . . . . 0.457 ' CD ' ' H ' ' B' ' 83' ' ' GLU . 11.8 mp0 -63.22 -49.01 75.86 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 113.209 -1.814 . . . . 0.0 108.787 178.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.27 -32.53 72.76 Favored 'General case' 0 C--O 1.192 -1.971 0 CA-C-N 115.187 -0.915 . . . . 0.0 112.09 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -64.01 -43.39 95.79 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-N 118.228 0.467 . . . . 0.0 111.74 177.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -62.82 -46.26 88.8 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -60.32 -44.51 95.4 Favored 'General case' 0 C--O 1.205 -1.245 0 CA-C-N 114.078 -1.419 . . . . 0.0 111.873 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.7 -54.41 47.43 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 123.579 0.752 . . . . 0.0 112.149 -178.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 35.3 pt -64.82 -32.21 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 121.289 0.566 . . . . 0.0 111.274 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -69.09 -51.58 37.16 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.336 177.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.408 ' HG3' ' HB3' ' A' ' 112' ' ' LEU . 4.1 tppp? -67.48 -45.19 76.6 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 123.443 0.697 . . . . 0.0 111.77 -178.243 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.59 -51.35 70.21 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.089 -176.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.534 ' HE2' ' SD ' ' B' ' 95' ' ' MET . 51.3 mtpt -78.47 -8.86 58.98 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.065 178.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 59.98 45.48 12.11 Favored 'General case' 0 CA--C 1.496 -1.13 0 CA-C-O 122.194 0.997 . . . . 0.0 108.497 -175.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.534 ' SD ' ' HE2' ' B' ' 93' ' ' LYS . 95.7 mmm -65.89 124.6 88.07 Favored Pre-proline 0 N--CA 1.422 -1.853 0 CA-C-N 113.359 -1.746 . . . . 0.0 110.704 -177.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.692 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 36.5 Cg_exo -64.03 -38.06 39.51 Favored 'Trans proline' 0 N--CA 1.433 -2.052 0 N-CA-C 107.107 -1.92 . . . . 0.0 107.107 168.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 97' ' ' ASP . . . . . 0.452 ' HB2' ' HB3' ' B' ' 95' ' ' MET . 7.0 t70 40.65 64.08 5.11 Favored Pre-proline 0 C--O 1.209 -1.034 0 CA-C-N 112.77 -2.014 . . . . 0.0 109.521 178.495 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.61 106.06 0.23 Allowed 'Trans proline' 0 C--N 1.361 1.185 0 C-N-CA 122.149 1.899 . . . . 0.0 111.986 -173.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 8.2 m-90 -76.68 44.07 0.35 Allowed 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 124.209 1.004 . . . . 0.0 109.997 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 100' ' ' ALA . . . . . 0.524 ' HB3' ' CZ ' ' A' ' 68' ' ' PHE . . . . . . . . 0 N--CA 1.393 -3.287 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.364 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -95.81 -62.79 1.23 Allowed 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 64.73 70.99 0.47 Allowed 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.771 1.229 . . . . 0.0 109.839 -174.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.541 HD23 HG12 ' A' ' 9' ' ' ILE . 12.3 tp -126.01 150.84 47.79 Favored 'General case' 0 N--CA 1.422 -1.826 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.1 p -78.2 143.52 37.09 Favored 'General case' 0 N--CA 1.421 -1.896 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.099 179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -55.73 -45.16 78.03 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.348 1.059 . . . . 0.0 112.512 -175.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.5 -41.18 96.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.023 0.44 . . . . 0.0 109.985 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -63.85 -42.51 97.56 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.846 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.578 HG22 ' HE3' ' A' ' 13' ' ' LYS . 65.4 mt -63.55 -37.38 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.991 176.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.68 -41.73 99.25 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.436 177.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -61.58 -44.19 97.48 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.608 175.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -59.53 -48.69 80.69 Favored 'General case' 0 C--O 1.197 -1.658 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.402 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE3' HG22 ' A' ' 9' ' ' ILE . 98.3 mttt -50.09 -43.87 51.72 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 122.966 0.506 . . . . 0.0 111.99 179.661 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.86 -59.44 3.29 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.405 -177.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.83 -33.6 75.09 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -175.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -63.51 -45.2 91.76 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 123.029 0.532 . . . . 0.0 110.029 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.8 m -74.11 -16.43 61.01 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.276 0.56 . . . . 0.0 110.966 178.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -79.13 -54.18 6.25 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.311 176.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -80.48 -20.73 43.04 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -174.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -67.81 101.08 1.01 Allowed 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 171.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -62.3 -7.7 4.71 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 116.083 1.883 . . . . 0.0 116.083 -171.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -109.95 -13.82 14.36 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.04 29.78 75.66 Favored Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.105 -176.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -104.34 -17.76 14.69 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.021 -0.671 . . . . 0.0 110.719 -176.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.95 4.16 63.45 Favored Glycine 0 N--CA 1.431 -1.693 0 C-N-CA 119.661 -1.257 . . . . 0.0 115.123 176.28 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.0 p -124.73 129.76 51.1 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 119.239 1.52 . . . . 0.0 109.582 170.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.9 mt -91.07 126.99 43.75 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.752 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.389 -174.047 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 p -102.57 167.01 10.2 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.15 173.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.8 p -53.73 -45.54 70.54 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 123.886 0.874 . . . . 0.0 113.005 -178.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -59.61 -34.98 73.45 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.495 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -70.35 -38.48 74.82 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.043 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.97 -47.87 84.46 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 175.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.44 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -64.28 -26.48 70.59 Favored Glycine 0 C--O 1.198 -2.151 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.473 179.245 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.7 m -68.99 -49.8 54.61 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 117.582 0.691 . . . . 0.0 110.565 179.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 30.4 m -70.62 -29.68 39.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.409 -0.516 . . . . 0.0 111.135 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.427 ' HG2' ' SD ' ' B' ' 95' ' ' MET . 66.9 mtt -69.13 -42.86 75.46 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 174.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 40.5 ttm180 -56.3 -39.57 72.95 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.344 1.458 . . . . 0.0 109.461 178.011 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 m -65.58 -32.64 74.33 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.141 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.462 HD12 ' SD ' ' B' ' 95' ' ' MET . 82.6 mt -87.97 -13.73 40.99 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.226 0.536 . . . . 0.0 110.275 178.328 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.74 47.11 2.36 Favored Glycine 0 N--CA 1.44 -1.064 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.783 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.43 ' HB2' ' HE2' ' B' ' 91' ' ' LYS . 50.1 tt0 -148.5 130.29 15.13 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 176.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -132.54 82.4 57.03 Favored Pre-proline 0 C--N 1.286 -2.175 0 C-N-CA 120.258 -0.577 . . . . 0.0 112.046 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -70.36 160.87 48.06 Favored 'Trans proline' 0 C--O 1.243 0.771 0 C-N-CA 122.581 2.187 . . . . 0.0 109.657 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.5 t -80.81 157.38 25.75 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.725 -176.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.82 -31.11 62.39 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.078 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.09 -42.66 95.13 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.726 0.298 . . . . 0.0 111.029 176.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 51' ' ' MET . 40.7 mt-10 -66.79 -43.25 84.44 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.459 0.647 . . . . 0.0 109.295 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 66.1 mt -64.31 -38.27 90.46 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.71 -178.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -66.33 -39.07 89.0 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.567 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.41 -38.99 88.69 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.677 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.408 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 24.4 mmt -60.83 -40.38 92.55 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.228 176.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.7 mt -66.19 -47.04 85.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.953 177.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.475 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.7 t30 -64.62 -12.61 47.45 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.797 -173.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -61.84 -40.17 94.36 Favored 'General case' 0 N--CA 1.392 -3.367 0 C-N-CA 123.861 0.864 . . . . 0.0 110.428 175.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.844 HG11 ' HB2' ' A' ' 71' ' ' MET . 19.3 m -112.21 -10.94 11.94 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.813 -178.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.475 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 24.3 t0 -73.53 103.23 4.08 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.371 0.605 . . . . 0.0 110.859 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.49 -11.12 49.89 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.023 -0.989 . . . . 0.0 111.693 -177.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -93.32 -11.49 32.29 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 119.869 -0.732 . . . . 0.0 110.566 -176.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 61.44 36.38 92.45 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -115.65 -12.14 11.6 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 122.732 -0.275 . . . . 0.0 110.967 -177.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.11 17.19 32.86 Favored Glycine 0 N--CA 1.434 -1.492 0 N-CA-C 115.373 0.909 . . . . 0.0 115.373 173.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.1 p -132.48 143.14 49.56 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-N 118.39 1.095 . . . . 0.0 111.49 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.9 mt -92.36 112.96 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -84.41 161.29 20.39 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 177.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.423 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 74.7 t80 -55.56 -50.04 89.22 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.685 0.394 . . . . 0.0 111.567 177.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.423 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 4.8 Cg_endo -49.68 -43.85 38.24 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 122.494 2.129 . . . . 0.0 112.671 173.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -71.78 -36.78 70.44 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.475 0.655 . . . . 0.0 110.045 -178.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -61.87 -43.82 98.06 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.751 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.1 mt -61.16 -45.45 94.6 Favored 'General case' 0 C--O 1.208 -1.131 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.269 178.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.5 m -57.12 -40.6 77.4 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 123.601 0.563 . . . . 0.0 110.536 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.844 ' HB2' HG11 ' A' ' 55' ' ' VAL . 27.5 ttp -55.51 -55.84 27.25 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.066 0.947 . . . . 0.0 112.143 -179.164 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -79.5 -38.55 34.13 Favored 'General case' 0 C--O 1.196 -1.711 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.26 -33.87 74.23 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -176.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -83.54 -19.17 36.15 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.896 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -83.07 -48.08 10.98 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.447 ' HA ' ' OG1' ' A' ' 79' ' ' THR 0.262 1.8 ppp? -103.91 104.77 14.8 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 122.397 1.094 . . . . 0.0 113.388 -179.668 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 52.6 mttp -119.18 -66.83 1.03 Allowed 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 175.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -140.79 30.51 1.86 Allowed 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 124.137 1.922 . . . . 0.0 105.869 178.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.564 HG23 ' HB2' ' A' ' 83' ' ' GLU . 61.1 m -64.71 -5.25 5.38 Favored 'General case' 0 C--N 1.283 -2.292 0 C-N-CA 129.454 3.102 . . . . 0.0 113.111 -174.336 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.94 -27.65 66.79 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 125.086 1.354 . . . . 0.0 109.901 -178.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.3 m -74.2 -51.42 15.51 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.506 -172.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -149.76 -38.81 0.15 Allowed 'General case' 0 C--O 1.205 -1.273 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 8.5 mm-40 -41.76 -59.6 1.62 Allowed 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 116.115 1.894 . . . . 0.0 116.115 -168.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -85.38 -24.78 27.41 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.908 0.861 . . . . 0.0 109.619 -175.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.45 HG23 ' HG2' ' A' ' 145' ' ' MET . 6.6 mm -73.46 -40.92 56.48 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.025 0 CA-C-N 114.436 -1.256 . . . . 0.0 108.762 -172.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -73.75 -26.67 60.78 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.855 178.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.565 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 43.1 mt-10 -64.02 -44.16 93.43 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 173.308 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -66.88 -37.01 83.6 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 114.552 -1.204 . . . . 0.0 110.803 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -72.18 -46.24 57.12 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.634 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.2 mtm180 -69.8 -18.28 63.46 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -177.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.475 HG12 ' O ' ' A' ' 88' ' ' ALA . 9.0 p -75.92 -20.57 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.037 178.44 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -97.0 -55.12 2.96 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -84.44 79.07 9.69 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.897 1.332 . . . . 0.0 109.367 176.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -78.59 -18.36 54.71 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 113.289 -1.778 . . . . 0.0 111.482 -176.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -91.33 -12.49 34.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.889 -177.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.83 45.79 49.74 Favored Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -94.86 -14.65 24.37 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.414 0.626 . . . . 0.0 109.967 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.18 8.09 82.22 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.552 177.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -142.95 138.95 30.48 Favored 'General case' 0 CA--C 1.491 -1.327 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -178.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.557 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.1 mt -97.56 124.98 50.8 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 174.314 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.6 m -102.02 150.53 23.13 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 123.831 0.707 . . . . 0.0 110.221 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.44 -45.06 81.1 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.74 -41.08 85.64 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 122.63 0.372 . . . . 0.0 110.752 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -59.15 -55.85 29.75 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.137 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.577 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.6 tt -59.93 -40.55 89.3 Favored 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.294 -172.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.448 ' HB2' HG21 ' A' ' 121' ' ' VAL . 0.0 OUTLIER -65.29 -38.87 91.57 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -63.07 -51.02 68.29 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.285 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.546 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -65.87 -31.51 54.06 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.38 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.371 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.577 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.4 mmt -62.55 -37.1 84.82 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 13.8 m -60.68 -46.55 89.92 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 175.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -69.08 -16.73 63.75 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 114.622 -1.172 . . . . 0.0 111.814 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 95.3 mt -100.9 -2.36 32.19 Favored 'General case' 0 C--N 1.316 -0.889 0 O-C-N 121.985 -0.447 . . . . 0.0 111.617 -177.218 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 81.02 1.24 89.84 Favored Glycine 0 C--O 1.237 0.301 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.466 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.436 ' HG3' ' SD ' ' A' ' 109' ' ' MET . 20.4 mm-40 -70.9 -48.69 52.32 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 52.08 73.47 0.32 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 124.519 1.137 . . . . 0.0 110.665 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.423 HD12 ' HG3' ' A' ' 109' ' ' MET . 82.1 mt -97.5 157.64 15.9 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.166 -177.549 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.4 p -76.82 158.64 30.7 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.497 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.407 ' HA ' HG22 ' A' ' 121' ' ' VAL . 3.9 p30 -67.84 -23.09 65.12 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-O 121.112 0.482 . . . . 0.0 109.892 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.81 -42.83 63.44 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 123.158 0.583 . . . . 0.0 110.375 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -68.22 -44.5 75.6 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.335 0.588 . . . . 0.0 109.863 -176.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.448 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.4 m -69.07 -29.58 43.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.143 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.84 -41.15 92.11 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.8 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -63.85 -43.51 95.94 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.425 ' HA ' ' CE2' ' B' ' 81' ' ' PHE . 55.4 mtt -53.89 -34.8 60.53 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.413 178.36 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.421 ' CG2' ' HA ' ' A' ' 135' ' ' GLN . 51.3 mm -86.23 -58.52 3.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.46 179.178 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.62 -38.35 86.75 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -171.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -70.15 -28.65 65.52 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.419 ' HA ' ' SD ' ' A' ' 144' ' ' MET . . . -80.18 -35.76 35.97 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.221 179.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.67 85.56 0.65 Allowed 'General case' 0 C--N 1.307 -1.276 0 CA-C-O 122.582 1.182 . . . . 0.0 112.424 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 28.9 mt -83.44 -8.74 11.41 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 CA-C-N 114.078 -1.419 . . . . 0.0 109.106 174.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.422 ' HB2' ' OE2' ' A' ' 140' ' ' GLU . 31.8 t70 -90.15 -12.47 38.11 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.607 -172.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.79 35.68 58.41 Favored Glycine 0 N--CA 1.433 -1.551 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.611 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -100.35 -16.87 17.5 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.444 0.64 . . . . 0.0 109.772 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.95 -2.28 85.53 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -176.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.421 ' HA ' ' CG2' ' A' ' 125' ' ' ILE . 21.9 mt-30 -138.37 147.29 43.27 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.634 1.173 . . . . 0.0 108.803 -178.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.557 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.4 p -86.69 121.11 37.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 C-N-CA 119.811 -0.756 . . . . 0.0 110.879 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -91.54 177.07 6.32 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.987 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.404 ' O ' HG13 ' A' ' 142' ' ' VAL . 85.5 t80 -70.05 -41.6 73.98 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.984 -173.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.411 ' HA ' HG22 ' A' ' 142' ' ' VAL . 44.7 mt-10 -63.94 -42.13 97.43 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.095 0.474 . . . . 0.0 111.408 -179.408 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.422 ' OE2' ' HB2' ' A' ' 131' ' ' ASP . 0.5 OUTLIER -70.48 -30.66 67.51 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.835 177.347 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -70.75 -45.37 64.94 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.054 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.411 HG22 ' HA ' ' A' ' 139' ' ' GLU . 23.9 m -62.45 -33.91 61.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-O 120.927 0.394 . . . . 0.0 110.828 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -60.9 -46.41 90.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.966 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.419 ' SD ' ' HA ' ' A' ' 128' ' ' ALA . 40.1 mtm -75.23 -40.17 59.29 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.693 -178.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.45 ' HG2' HG23 ' A' ' 85' ' ' ILE . 10.0 tpt -61.22 -32.29 72.06 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.508 -175.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 22.9 p -89.52 -10.86 44.63 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-O 121.284 0.564 . . . . 0.0 111.703 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -108.95 27.46 9.47 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 122.77 1.271 . . . . 0.0 108.172 178.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.589 ' NZ ' ' HB3' ' A' ' 148' ' ' LYS . 0.8 OUTLIER . . . . . 0 C--N 1.281 -2.41 0 CA-C-N 113.759 -1.564 . . . . 0.0 108.632 -176.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 22.4 m . . . . . 0 N--CA 1.437 -1.087 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -63.14 145.74 93.83 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 121.995 1.797 . . . . 0.0 110.234 177.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -54.18 -48.26 71.14 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.311 0.645 . . . . 0.0 112.114 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -65.53 -42.58 91.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.382 -179.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 13.5 m -68.02 -36.23 79.6 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.011 0.434 . . . . 0.0 110.584 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -66.66 -49.51 65.94 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 178.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 25.4 t-80 -60.3 -38.54 83.97 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 81' ' ' PHE . . . . . 0.425 ' CE2' ' HA ' ' A' ' 124' ' ' MET . 12.6 t80 -56.05 -52.47 64.14 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 124.314 1.046 . . . . 0.0 111.451 175.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -69.35 -25.77 64.35 Favored 'General case' 0 C--O 1.247 0.947 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -177.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -80.26 -44.06 20.29 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.099 0.476 . . . . 0.0 110.147 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.84 -37.16 83.43 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.055 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.443 ' O ' HG13 ' B' ' 89' ' ' ILE . 48.2 m95 -57.56 -45.66 84.87 Favored 'General case' 0 C--O 1.206 -1.235 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 176.752 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -55.56 -49.51 72.48 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 122.512 1.149 . . . . 0.0 109.811 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -66.41 -36.6 83.25 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 113.149 -1.841 . . . . 0.0 111.195 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -77.44 -41.28 40.36 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.443 HG13 ' O ' ' B' ' 85' ' ' TRP . 83.1 mt -57.85 -50.99 75.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 122.943 0.497 . . . . 0.0 111.886 -178.169 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -68.18 -31.39 70.9 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.615 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' A' ' 112' ' ' LEU . 3.6 tppp? -65.99 -46.29 78.53 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.839 177.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.69 92.63 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.265 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -68.75 -13.6 62.49 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.299 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 94' ' ' HIS . . . . . 0.401 ' HA ' HE22 ' A' ' 41' ' ' GLN . 58.4 m80 72.11 19.68 4.49 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.236 1.014 . . . . 0.0 110.199 -177.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.462 ' SD ' HD12 ' A' ' 39' ' ' LEU . 75.3 mtp 51.14 78.82 0.38 Allowed Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 114.538 1.31 . . . . 0.0 114.538 -177.063 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -88.88 6.7 4.56 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.455 2.104 . . . . 0.0 109.441 175.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -132.05 117.91 16.14 Favored Pre-proline 0 N--CA 1.429 -1.502 0 CA-C-N 114.201 -1.363 . . . . 0.0 108.91 -176.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -75.05 95.74 0.99 Allowed 'Trans proline' 0 N--CA 1.44 -1.623 0 N-CA-C 107.078 -1.932 . . . . 0.0 107.078 168.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 33.0 p-90 -78.62 119.62 22.14 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 -172.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.414 -2.263 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 175.504 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.257 0 CA-C-O 121.406 0.622 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.416 ' HB3' ' HA ' ' A' ' 70' ' ' THR . 1.6 p30 -86.23 91.95 8.62 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.48 1.133 . . . . 0.0 113.689 -177.087 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -103.26 113.74 27.47 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 173.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.429 HD23 HG12 ' A' ' 9' ' ' ILE . 9.3 tp -132.38 145.45 51.24 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 -177.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.0 p -82.32 145.36 29.99 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -176.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -51.08 -50.59 58.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.812 1.245 . . . . 0.0 113.371 -176.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -66.72 -34.96 79.01 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.257 0.551 . . . . 0.0 110.705 -177.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.615 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 52.0 tp60 -74.36 -36.33 63.59 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.307 -178.039 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.429 HG12 HD23 ' A' ' 4' ' ' LEU . 68.8 mt -60.55 -40.67 85.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.939 176.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.93 -38.81 92.5 Favored 'General case' 0 C--O 1.255 1.376 0 CA-C-O 121.334 0.588 . . . . 0.0 110.647 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -62.88 -45.51 92.19 Favored 'General case' 0 C--O 1.249 1.059 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.255 177.081 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.615 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 23.1 m-85 -60.45 -38.75 85.17 Favored 'General case' 0 C--O 1.197 -1.667 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.837 178.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.479 ' HG2' ' CZ ' ' A' ' 65' ' ' PHE . 98.9 mttt -55.17 -51.12 67.51 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 121.026 0.441 . . . . 0.0 111.304 177.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -68.04 -46.85 69.99 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.291 -178.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.606 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -70.52 -21.87 62.69 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.995 -176.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -67.51 -53.56 27.54 Favored 'General case' 0 CA--C 1.486 -1.513 0 C-N-CA 123.41 0.684 . . . . 0.0 109.408 174.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 t -67.4 -16.82 64.45 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 121.018 0.437 . . . . 0.0 110.359 -177.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.606 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 16.7 tp -59.35 -46.84 87.52 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.56 172.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.628 ' HB2' HG11 ' A' ' 35' ' ' VAL . 25.2 p90 -101.42 -25.79 13.81 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.985 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -75.98 99.15 4.47 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 174.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -48.96 -34.52 13.11 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 116.767 2.136 . . . . 0.0 116.767 -170.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.1 p30 -110.47 -13.11 14.31 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 27.58 73.66 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.813 -0.232 . . . . 0.0 112.851 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -81.65 -16.48 51.26 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.165 0.507 . . . . 0.0 110.952 -176.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.43 0.26 46.83 Favored Glycine 0 N--CA 1.434 -1.442 0 C-N-CA 120.657 -0.783 . . . . 0.0 114.252 -178.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.446 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 67.2 p -128.89 129.4 45.48 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 118.898 1.349 . . . . 0.0 109.955 173.508 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.6 mt -89.38 111.97 23.68 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 179.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.6 p -87.74 170.04 11.58 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.993 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.3 p -63.02 -33.57 75.71 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 123.019 0.2 . . . . 0.0 110.852 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -52.61 -54.82 27.92 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.253 174.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.75 -45.04 79.86 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.188 -174.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 71.5 mt -60.17 -45.68 92.28 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 178.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.98 -29.04 67.52 Favored Glycine 0 C--O 1.207 -1.532 0 C-N-CA 118.997 -1.573 . . . . 0.0 112.188 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.8 m -69.57 -44.12 71.47 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 117.255 0.528 . . . . 0.0 110.436 177.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.628 HG11 ' HB2' ' A' ' 19' ' ' PHE . 25.1 m -66.76 -36.21 76.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-O 121.149 0.499 . . . . 0.0 109.949 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.533 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 63.2 mtt -68.46 -42.51 78.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.607 176.063 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 68.5 ttt180 -62.85 -25.59 68.35 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 123.873 0.869 . . . . 0.0 110.819 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.0 m -63.09 -30.25 71.45 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.349 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -98.05 9.34 43.07 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 120.9 0.381 . . . . 0.0 111.077 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.42 -9.7 75.54 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.767 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.401 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 62.1 tt0 -71.8 118.36 14.55 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -113.41 84.43 7.7 Favored Pre-proline 0 C--N 1.289 -2.052 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.533 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 73.1 Cg_endo -89.65 162.33 5.25 Favored 'Trans proline' 0 N--CA 1.434 -2.015 0 C-N-CA 122.409 2.072 . . . . 0.0 111.237 177.546 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.2 p -89.13 167.53 13.05 Favored 'General case' 0 C--N 1.283 -2.297 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 175.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -64.84 -30.21 71.2 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.54 89.35 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.708 0.289 . . . . 0.0 110.834 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -66.8 -38.47 86.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.535 0.683 . . . . 0.0 110.584 179.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.409 HD21 ' HG2' ' A' ' 43' ' ' PRO . 77.1 mt -68.67 -44.8 73.27 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.149 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -63.49 -34.88 78.75 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.718 -1.128 . . . . 0.0 109.847 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.22 -43.19 98.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.707 177.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 14.6 tpt -69.06 -36.31 77.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.373 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 67.8 mt -63.31 -55.76 21.22 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.367 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.43 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -57.9 -31.8 67.12 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 123.411 0.684 . . . . 0.0 112.007 -175.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.47 -31.88 66.39 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 123.955 0.902 . . . . 0.0 110.048 178.16 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.644 HG11 ' SD ' ' A' ' 71' ' ' MET . 32.9 m -114.89 -11.4 12.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 O-C-N 121.825 -0.547 . . . . 0.0 112.12 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -76.26 114.55 15.06 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 -174.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.85 -10.39 53.54 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.191 -178.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -106.99 -12.37 15.45 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.717 -176.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.78 44.8 94.05 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -175.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -115.37 0.83 13.56 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -174.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.02 23.6 37.67 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.191 -1.004 . . . . 0.0 113.86 173.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.446 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 1.7 p -150.73 142.05 23.3 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 116.981 0.391 . . . . 0.0 111.364 179.03 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.3 mt -97.97 104.19 15.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 175.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.56 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 6.7 t70 -78.84 164.81 24.18 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 -178.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.479 ' CZ ' ' HG2' ' A' ' 13' ' ' LYS . 61.3 t80 -52.68 -50.39 81.06 Favored Pre-proline 0 CA--C 1.554 1.112 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.56 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 4.8 Cg_endo -49.81 -49.6 15.51 Favored 'Trans proline' 0 C--N 1.364 1.375 0 C-N-CA 122.735 2.29 . . . . 0.0 112.019 172.184 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -63.05 -37.98 89.37 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.268 0.556 . . . . 0.0 109.753 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.417 ' O ' ' HG2' ' A' ' 72' ' ' MET . 39.7 t80 -64.33 -39.34 93.7 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.417 178.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.9 mt -66.55 -42.49 87.05 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.416 ' HA ' ' HB3' ' A' ' 2' ' ' ASP . 86.6 m -57.53 -45.29 85.2 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.041 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.644 ' SD ' HG11 ' A' ' 55' ' ' VAL . 42.6 ttp -64.94 -37.96 89.38 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.493 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 28.7 mmt -63.91 -43.3 96.36 Favored 'General case' 0 C--N 1.321 -0.674 0 O-C-N 122.259 -0.276 . . . . 0.0 110.863 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.97 -35.05 79.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.063 0.459 . . . . 0.0 109.895 176.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -69.88 -23.73 63.3 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.327 1.051 . . . . 0.0 110.749 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.459 ' HD3' ' O ' ' A' ' 71' ' ' MET . 4.1 mptp? -81.03 -20.41 41.76 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 121.888 -0.508 . . . . 0.0 111.377 177.377 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.442 ' HG3' ' HG3' ' A' ' 77' ' ' LYS . 21.5 ptp -123.36 -32.03 3.46 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -171.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.442 ' HG3' ' HG3' ' A' ' 76' ' ' MET . 50.4 mttm -128.72 -62.39 1.02 Allowed 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.112 0.482 . . . . 0.0 111.635 -172.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -89.25 45.78 1.32 Allowed 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 122.873 1.321 . . . . 0.0 108.268 -175.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.7 m -71.65 109.75 5.77 Favored 'General case' 0 N--CA 1.406 -2.651 0 CA-C-N 114.015 -1.448 . . . . 0.0 109.096 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -69.11 -50.11 51.06 Favored 'General case' 0 CA--C 1.501 -0.931 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.971 -177.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.421 ' C ' ' H ' ' A' ' 83' ' ' GLU . 18.9 m -119.19 146.43 45.18 Favored 'General case' 0 N--CA 1.421 -1.91 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -74.64 17.79 0.19 Allowed 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.68 0.392 . . . . 0.0 111.613 -175.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.421 ' H ' ' C ' ' A' ' 81' ' ' SER . 9.2 tp10 -58.29 -50.27 74.21 Favored 'General case' 0 C--O 1.205 -1.272 0 C-N-CA 123.4 0.68 . . . . 0.0 109.448 -178.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HA ' ' HB2' ' A' ' 87' ' ' GLU . 42.8 mm-40 -64.96 -29.29 70.21 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -178.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 30.0 mm -71.67 -47.28 58.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.0 ttm-85 -70.39 -30.08 66.89 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.87 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.422 ' HB2' ' HA ' ' A' ' 84' ' ' GLU . 7.5 mm-40 -56.47 -47.4 79.29 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.965 0.906 . . . . 0.0 112.162 174.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.48 94.86 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.091 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.18 -45.55 87.89 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-O 121.351 0.596 . . . . 0.0 109.51 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -56.34 -41.79 76.65 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 126.571 1.948 . . . . 0.0 111.987 -179.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.1 p -73.39 -27.06 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.118 -177.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -84.33 -60.06 2.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.647 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -79.59 81.86 5.79 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 121.981 0.896 . . . . 0.0 110.833 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -79.1 -38.43 36.24 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.493 -1.231 . . . . 0.0 111.987 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -73.55 -13.87 61.1 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 121.28 0.562 . . . . 0.0 111.036 -176.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.41 60.25 4.15 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.993 175.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 37.5 m-80 -99.33 -10.29 22.49 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.03 0.443 . . . . 0.0 110.755 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.82 1.88 84.73 Favored Glycine 0 CA--C 1.498 -0.982 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -153.5 150.13 28.43 Favored 'General case' 0 N--CA 1.412 -2.356 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.592 ' HB ' HG13 ' A' ' 136' ' ' VAL . 5.4 mt -98.55 124.36 51.66 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.114 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.1 m -101.59 159.04 15.64 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.08 -42.12 89.67 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.16 -44.3 89.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.295 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.635 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 3.1 tp10 -59.11 -46.76 87.48 Favored 'General case' 0 CA--C 1.494 -1.184 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.898 176.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.552 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.7 tt -62.3 -36.63 82.72 Favored 'General case' 0 N--CA 1.418 -2.039 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -174.377 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.2 -32.53 71.88 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.323 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.635 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 48.0 m170 -53.49 -55.61 23.91 Favored 'General case' 0 C--O 1.26 1.658 0 CA-C-O 121.478 0.656 . . . . 0.0 110.117 177.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.421 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.7 p -65.79 -34.68 71.94 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.06 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.538 -178.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.552 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 19.8 mmt -62.13 -43.11 99.56 Favored 'General case' 0 CA--C 1.491 -1.324 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 m -59.43 -37.78 78.95 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.033 177.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -79.02 -22.91 44.75 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.2 177.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 93.0 mt -84.96 -20.0 31.27 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.778 0.323 . . . . 0.0 110.81 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 103.0 2.67 48.85 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.569 178.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -85.3 115.73 23.23 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.326 0.584 . . . . 0.0 111.279 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -85.8 76.13 9.95 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.454 HD12 ' HG3' ' A' ' 109' ' ' MET . 66.2 mt -101.14 147.54 26.13 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.011 -177.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.9 p -83.86 165.76 18.49 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.144 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -64.78 -39.28 93.35 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 1.5 mp0 -54.5 -49.71 69.52 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.169 176.631 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -59.4 -54.5 45.95 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.902 -176.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.456 ' O ' HG12 ' A' ' 125' ' ' ILE . 18.3 m -65.78 -35.79 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.378 -175.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.579 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 11.3 t70 -66.85 -42.06 86.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.357 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -69.92 -29.15 66.25 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.172 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.445 ' HE2' ' HB1' ' B' ' 84' ' ' ALA . 66.3 mtt -58.89 -49.66 76.95 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 173.48 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.9 mm -53.37 -46.44 58.07 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.603 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.661 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 27.5 mmt180 -62.07 -32.34 72.86 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -175.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -79.38 -35.89 40.09 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 120.1 -0.64 . . . . 0.0 111.241 178.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.464 ' HA ' ' HG2' ' A' ' 144' ' ' MET . . . -79.81 -21.36 44.36 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 121.706 0.765 . . . . 0.0 110.467 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -82.5 88.39 6.63 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.408 173.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 61.4 mt -81.85 -42.62 19.29 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -75.8 -9.29 58.47 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.8 53.84 3.86 Favored Glycine 0 N--CA 1.438 -1.213 0 C-N-CA 120.545 -0.836 . . . . 0.0 111.813 175.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -105.38 -10.35 17.03 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 90.72 -8.81 79.25 Favored Glycine 0 CA--C 1.499 -0.941 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.115 176.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -141.35 138.3 32.97 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.592 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.8 OUTLIER -81.78 114.67 23.06 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 N-CA-C 113.159 0.799 . . . . 0.0 113.159 -175.446 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -90.66 163.62 14.46 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.779 ' O ' HG23 ' A' ' 142' ' ' VAL . 47.4 t80 -55.5 -59.92 4.15 Favored 'General case' 0 C--O 1.198 -1.62 0 CA-C-O 117.96 -1.019 . . . . 0.0 113.165 -174.285 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -53.71 -37.15 62.99 Favored 'General case' 0 CA--C 1.561 1.399 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -172.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -73.95 -35.07 64.52 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 120.121 -0.631 . . . . 0.0 110.44 178.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -66.51 -41.74 88.4 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.182 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 138' ' ' TYR . 6.3 t -52.6 -43.03 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.424 0 C-N-CA 124.47 1.108 . . . . 0.0 109.841 177.573 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -66.82 -55.92 12.7 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.92 -178.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.464 ' HG2' ' HA ' ' A' ' 128' ' ' ALA . 3.1 ppp? -76.47 -20.45 56.99 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -174.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.7 ttt -73.16 -35.39 66.44 Favored 'General case' 0 C--O 1.242 0.689 0 CA-C-O 120.971 0.415 . . . . 0.0 110.117 175.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 25.1 p -86.75 -40.51 14.95 Favored 'General case' 0 N--CA 1.435 -1.207 0 C-N-CA 119.763 -0.775 . . . . 0.0 110.186 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -96.41 89.31 5.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 121.712 0.768 . . . . 0.0 109.884 179.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.588 ' O ' ' HD2' ' A' ' 148' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.297 -1.702 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.116 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 74' ' ' SER . . . . . 0.404 ' HA ' ' HD3' ' B' ' 75' ' ' PRO . 5.0 m . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 75' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' B' ' 74' ' ' SER . 3.8 Cg_exo -77.65 -82.75 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 121.661 1.574 . . . . 0.0 111.754 178.466 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -175.18 -174.12 0.72 Allowed 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 -179.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -137.77 -18.5 1.22 Allowed 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 120.794 0.331 . . . . 0.0 111.076 178.011 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.9 m -85.19 16.35 3.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.51 0.671 . . . . 0.0 111.392 -177.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -120.16 29.2 7.62 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 176.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -59.74 -24.5 64.08 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.363 -176.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -57.18 -45.48 83.66 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 174.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 82' ' ' LYS . . . . . 0.577 ' O ' ' HG3' ' B' ' 86' ' ' LYS . 13.0 mptt -74.27 -30.75 62.26 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.295 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.47 -36.97 85.9 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 174.082 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.445 ' HB1' ' HE2' ' A' ' 124' ' ' MET . . . -65.47 -46.21 80.68 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.508 175.446 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -61.65 -24.91 67.04 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 86' ' ' LYS . . . . . 0.624 ' HG2' ' OE1' ' B' ' 90' ' ' GLN . 67.1 mttm -68.79 -31.42 70.42 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.163 0.506 . . . . 0.0 110.549 175.682 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 87' ' ' HIS . . . . . 0.561 ' O ' ' HB3' ' B' ' 91' ' ' LYS . 74.8 m80 -84.07 -29.7 26.62 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.555 177.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -86.4 -63.15 1.36 Allowed 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -177.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 64.7 mt -81.57 -58.39 3.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 O-C-N 122.198 -0.314 . . . . 0.0 111.085 -173.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 90' ' ' GLN . . . . . 0.624 ' OE1' ' HG2' ' B' ' 86' ' ' LYS . 46.3 mt-30 -59.1 -36.06 74.5 Favored 'General case' 0 C--O 1.202 -1.421 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.163 -178.221 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.561 ' HB3' ' O ' ' B' ' 87' ' ' HIS . 20.3 tptp -80.67 -33.31 35.61 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.437 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.13 -46.44 77.51 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.571 0.7 . . . . 0.0 110.744 179.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.2 mmmt -91.53 9.61 31.34 Favored 'General case' 0 C--O 1.196 -1.727 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.937 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 94' ' ' HIS . . . . . 0.458 ' HB2' ' HA ' ' B' ' 91' ' ' LYS . 8.5 t-80 -75.37 -13.31 60.4 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -173.108 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.541 ' HG3' ' O ' ' A' ' 35' ' ' VAL . 19.4 tpp -134.25 -42.92 0.03 OUTLIER Pre-proline 0 C--N 1.293 -1.854 0 C-N-CA 119.316 -0.953 . . . . 0.0 112.975 -170.377 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.424 ' CD ' ' H ' ' B' ' 95' ' ' MET . 6.4 Cg_exo -79.31 7.6 4.35 Favored 'Trans proline' 0 C--N 1.379 2.177 0 C-N-CA 121.411 1.407 . . . . 0.0 111.417 175.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -160.26 146.68 11.9 Favored Pre-proline 0 C--N 1.31 -1.136 0 N-CA-C 104.725 -2.324 . . . . 0.0 104.725 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -75.04 89.98 1.12 Allowed 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 121.013 1.142 . . . . 0.0 113.213 176.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 99' ' ' TRP . . . . . 0.442 ' NE1' ' HG2' ' B' ' 90' ' ' GLN . 3.1 t90 -132.18 137.04 47.47 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 176.271 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 100' ' ' ALA . . . . . 0.546 ' HB1' ' HB3' ' A' ' 15' ' ' ALA . . . . . . . . 0 C--N 1.301 -1.507 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.45 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.312 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -119.88 -17.96 8.36 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.053 0.454 . . . . 0.0 110.049 176.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -112.7 159.12 19.24 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 177.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 4' ' ' LEU . 11.1 tp -131.82 147.78 52.51 Favored 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.863 -175.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.9 p -74.68 142.84 44.44 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -67.25 -30.25 70.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -171.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -63.43 -40.09 96.24 Favored 'General case' 0 C--O 1.245 0.859 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 177.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.443 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 6.6 tp-100 -72.95 -36.32 67.15 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.376 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.47 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 64.7 mt -61.64 -37.84 78.88 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.945 176.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.1 -43.12 99.36 Favored 'General case' 0 C--O 1.256 1.408 0 CA-C-O 121.646 0.736 . . . . 0.0 110.371 176.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -60.62 -41.24 94.46 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.611 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.453 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 21.3 m-85 -74.96 -12.0 60.24 Favored 'General case' 0 C--O 1.189 -2.125 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 177.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 67.7 mttm -69.58 -48.81 58.92 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 173.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.72 -39.91 88.18 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 119.699 -0.8 . . . . 0.0 110.084 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.453 ' HB3' ' HA ' ' A' ' 12' ' ' PHE . . . -69.56 -24.14 63.66 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.409 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.578 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 70.1 t80 -68.52 -52.34 33.12 Favored 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 176.562 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 m -69.55 -16.69 63.47 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.15 -178.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.405 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 41.5 tp -62.78 -31.86 72.91 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 173.084 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.536 ' CD2' HG21 ' A' ' 35' ' ' VAL . 8.8 m-85 -98.29 -43.13 7.08 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.771 177.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -79.43 87.44 5.06 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 122.143 0.973 . . . . 0.0 109.222 176.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 27.5 mmmt -71.27 -26.22 62.8 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 114.046 -1.434 . . . . 0.0 112.358 -172.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.605 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 1.5 m-20 -90.98 -13.17 33.88 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.754 -177.273 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.46 58.41 9.46 Favored Glycine 0 C--O 1.223 -0.564 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.404 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.605 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 10.3 m-20 -112.12 -16.74 12.97 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -176.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.31 11.4 58.48 Favored Glycine 0 C--N 1.313 -0.722 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 -173.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.414 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 11.2 p -144.7 136.83 26.09 Favored 'General case' 0 N--CA 1.441 -0.925 0 C-N-CA 123.369 0.668 . . . . 0.0 110.167 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 56.9 mt -104.87 127.92 59.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 p -103.18 172.91 6.55 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.922 177.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.3 p -64.34 -27.98 69.4 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.881 0.372 . . . . 0.0 111.182 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -53.18 -54.01 42.12 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 124.553 1.141 . . . . 0.0 109.392 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.526 ' HB3' ' O ' ' A' ' 19' ' ' PHE . 35.1 mt-10 -71.2 -38.81 72.05 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 113.719 -1.582 . . . . 0.0 111.271 -174.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -59.32 -49.39 78.0 Favored 'General case' 0 C--O 1.208 -1.112 0 O-C-N 123.447 0.467 . . . . 0.0 110.907 176.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.13 -27.67 72.61 Favored Glycine 0 C--O 1.222 -0.613 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.465 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.2 m -65.7 -50.08 66.18 Favored 'General case' 0 C--O 1.262 1.739 0 CA-C-O 121.693 0.759 . . . . 0.0 109.591 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.697 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 34.8 m -73.35 -41.08 57.3 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.194 -178.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -48.12 75.61 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 123.166 0.587 . . . . 0.0 110.948 177.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -58.26 -39.56 79.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.943 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.8 m -68.63 -27.32 65.91 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 121.328 0.585 . . . . 0.0 111.164 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 52.3 mt -84.1 -20.27 32.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.324 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.22 19.02 40.43 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.4 ' C ' ' HD3' ' A' ' 43' ' ' PRO . 3.4 tp-100 -106.07 120.56 42.1 Favored 'General case' 0 N--CA 1.428 -1.573 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 -178.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -126.11 69.23 66.34 Favored Pre-proline 0 C--N 1.301 -1.539 0 C-N-CA 118.663 -1.215 . . . . 0.0 112.866 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.4 ' HD3' ' C ' ' A' ' 41' ' ' GLN . 5.7 Cg_exo -77.25 163.12 30.63 Favored 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 122.293 1.995 . . . . 0.0 109.875 175.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.426 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 22.8 p -75.29 161.77 29.01 Favored 'General case' 0 C--N 1.295 -1.804 0 CA-C-O 120.46 0.172 . . . . 0.0 111.163 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -57.39 -36.1 70.85 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 177.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.17 -49.69 76.13 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.464 178.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 8.1 mm-40 -64.22 -42.59 96.52 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.755 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.34 -45.72 89.92 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.557 0.535 . . . . 0.0 111.48 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.4 tm0? -66.63 -40.12 88.6 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -62.46 -38.06 88.36 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.978 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 21.7 mmt -58.49 -40.07 81.78 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.21 175.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.9 mt -67.28 -56.54 13.13 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.15 176.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.49 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.4 t30 -57.34 -26.2 60.61 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.488 0.715 . . . . 0.0 112.554 -173.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.57 -46.11 89.83 Favored 'General case' 0 N--CA 1.427 -1.621 0 C-N-CA 123.113 0.565 . . . . 0.0 109.503 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.604 HG11 ' SD ' ' A' ' 71' ' ' MET . 35.3 m -93.71 -19.77 6.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.274 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.49 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 44.8 t0 -67.89 106.84 2.43 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.184 -179.065 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.55 -9.71 53.65 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.582 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -101.71 -12.56 18.28 Favored 'General case' 0 CA--C 1.497 -1.088 0 C-N-CA 119.263 -0.975 . . . . 0.0 110.284 -173.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 61.23 39.09 96.7 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -172.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -108.14 -2.23 19.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.867 0.365 . . . . 0.0 110.963 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.52 9.14 82.07 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 121.088 -0.577 . . . . 0.0 114.308 172.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.414 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 26.2 p -134.88 150.94 50.52 Favored 'General case' 0 C--O 1.256 1.416 0 CA-C-N 117.5 0.65 . . . . 0.0 111.58 179.355 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 45.8 mt -91.88 106.64 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 176.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -77.16 163.86 26.19 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.421 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 48.5 t80 -52.01 -53.83 47.47 Favored Pre-proline 0 CA--C 1.561 1.377 0 O-C-N 123.681 0.613 . . . . 0.0 112.33 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -52.44 -38.49 74.16 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.988 2.459 . . . . 0.0 113.341 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -71.2 -43.37 67.53 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 121.243 0.544 . . . . 0.0 110.142 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.578 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 56.5 t80 -62.57 -41.77 99.14 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.455 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 91.4 mt -63.17 -49.49 74.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.749 177.445 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.7 m -57.75 -46.94 83.8 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.604 ' SD ' HG11 ' A' ' 55' ' ' VAL . 16.6 ptt? -67.72 -32.07 72.45 Favored 'General case' 0 CA--C 1.507 -0.692 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.374 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.1 tpp -71.22 -37.27 72.05 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.73 -30.11 71.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.613 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -75.41 -28.69 59.52 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.019 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 71' ' ' MET . 94.4 mttt -69.85 -29.75 67.07 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.062 -179.226 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -88.75 94.65 9.98 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 166.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -44.9 -82.96 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.319 1.448 . . . . 0.0 112.948 -172.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -154.47 27.09 0.45 Allowed 'General case' 0 CA--C 1.475 -1.913 0 CA-C-O 124.519 2.104 . . . . 0.0 106.051 176.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.414 ' HB ' ' HB2' ' A' ' 83' ' ' GLU . 1.8 p -150.44 132.51 15.29 Favored 'General case' 1 N--CA 1.369 -4.496 0 CA-C-N 110.925 -2.852 . . . . 0.0 105.55 -177.873 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -128.74 -45.59 1.3 Allowed 'General case' 0 C--N 1.305 -1.35 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.656 178.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.2 m -70.25 -35.88 74.1 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.532 -173.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -101.53 -25.92 13.73 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.182 0.515 . . . . 0.0 111.614 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.414 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 27.2 tp10 -66.53 -46.32 76.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.681 -175.306 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -59.39 -43.68 92.91 Favored 'General case' 0 CA--C 1.501 -0.928 0 O-C-N 124.119 0.887 . . . . 0.0 110.666 -176.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.658 ' HA ' ' SD ' ' A' ' 145' ' ' MET . 7.0 mm -63.95 -49.64 80.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.574 -1.193 . . . . 0.0 109.302 -174.271 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -69.21 -33.43 73.31 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.969 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -63.74 -53.28 53.52 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.16 -46.01 91.13 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.787 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -60.44 -48.14 83.05 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.096 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.584 ' NE ' ' HA ' ' A' ' 90' ' ' ARG . 0.8 OUTLIER -60.23 -36.66 78.22 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.187 -178.169 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.7 p -75.89 -26.01 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 120.516 -0.474 . . . . 0.0 111.602 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -80.88 -56.32 4.2 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 176.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -88.9 86.15 6.89 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 122.009 0.909 . . . . 0.0 109.201 178.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -78.02 -21.6 50.51 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.249 -174.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.547 ' HB3' ' ND2' ' A' ' 97' ' ' ASN . 13.3 t70 -83.52 -15.13 50.56 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -177.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.509 ' HA2' ' NH2' ' A' ' 90' ' ' ARG . . . 72.06 51.18 14.98 Favored Glycine 0 N--CA 1.44 -1.057 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.804 179.628 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.547 ' ND2' ' HB3' ' A' ' 95' ' ' ASP . 39.6 m-80 -84.1 -19.61 33.96 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.832 0.348 . . . . 0.0 110.168 -178.216 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.68 -2.91 86.71 Favored Glycine 0 C--O 1.227 -0.319 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.432 ' CE1' ' HB2' ' A' ' 137' ' ' ASN . 91.9 m-85 -143.47 150.11 38.51 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.2 mt -111.36 133.16 57.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 177.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.2 m -98.7 156.96 16.57 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.69 -49.48 62.52 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -173.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.26 -33.75 76.73 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 36.3 tt0 -64.96 -46.97 79.33 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.469 176.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.471 HD21 ' SD ' ' A' ' 124' ' ' MET . 9.1 tt -65.31 -36.51 84.29 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.573 ' HA ' HG11 ' A' ' 121' ' ' VAL . 26.1 ttp180 -62.38 -38.44 89.6 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.322 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 104' ' ' GLU . 44.0 m170 -61.62 -54.2 46.02 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.067 176.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 6.3 p -61.98 -36.36 73.59 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.55 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.659 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.3 mmt -64.28 -41.41 96.92 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-O 121.011 0.434 . . . . 0.0 111.08 178.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.2 m -66.07 -33.88 76.79 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 178.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -75.1 -25.17 58.31 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.539 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.4 mt -87.93 -20.36 26.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.333 0.587 . . . . 0.0 110.721 -178.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.39 -14.06 43.29 Favored Glycine 0 C--N 1.305 -1.149 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.898 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.426 ' OE2' ' HG2' ' B' ' 91' ' ' LYS . 1.1 mp0 -61.85 -42.57 99.21 Favored 'General case' 0 CA--C 1.504 -0.825 0 C-N-CA 123.043 0.537 . . . . 0.0 110.053 177.249 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 54.5 35.83 24.28 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.454 1.096 . . . . 0.0 111.314 176.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.5 mt -57.95 143.31 43.41 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.246 -177.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 16.7 p -70.21 168.39 15.86 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 123.599 0.562 . . . . 0.0 110.539 178.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.52 ' HA ' HG22 ' A' ' 121' ' ' VAL . 11.4 t70 -62.81 -35.39 79.76 Favored 'General case' 0 C--O 1.215 -0.735 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -177.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -53.33 -54.58 34.44 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.546 1.138 . . . . 0.0 111.024 176.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -71.69 -38.37 70.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.118 -175.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.573 HG11 ' HA ' ' A' ' 106' ' ' ARG . 11.9 m -70.95 -33.94 53.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.891 -178.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -71.97 -36.36 69.79 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -60.96 -46.37 90.99 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 175.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.471 ' SD ' HD21 ' A' ' 105' ' ' LEU . 35.5 mtt -53.53 -50.45 65.45 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.735 175.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 121' ' ' VAL . 47.3 mm -63.2 -57.2 12.99 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.506 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.557 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -54.95 -42.23 72.07 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -171.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.513 ' HB2' ' CE1' ' B' ' 81' ' ' PHE . 21.3 mm-40 -74.67 -30.77 61.7 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.412 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -84.0 -27.28 28.53 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.339 0.59 . . . . 0.0 110.502 -179.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.442 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 7.7 t70 -67.66 96.17 0.53 Allowed 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 125.626 1.57 . . . . 0.0 109.419 175.123 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.1 mt -82.68 -48.49 17.88 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.836 -176.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.86 -11.3 60.88 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 121.137 0.494 . . . . 0.0 112.245 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.442 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 72.9 47.06 26.78 Favored Glycine 0 C--N 1.306 -1.105 0 N-CA-C 110.814 -0.914 . . . . 0.0 110.814 178.065 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -98.73 -16.41 18.98 Favored 'General case' 0 C--N 1.306 -1.309 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -178.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.1 10.39 61.15 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -147.77 134.17 19.64 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 124.729 1.212 . . . . 0.0 107.92 -176.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.405 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 0.7 OUTLIER -88.02 121.56 38.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 CA-C-O 120.564 0.221 . . . . 0.0 111.392 -179.491 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.432 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 20.5 t30 -85.77 154.47 21.58 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.304 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.543 ' O ' HG13 ' A' ' 142' ' ' VAL . 42.1 t80 -56.01 -47.55 77.57 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.336 1.054 . . . . 0.0 110.407 178.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.55 -21.62 66.74 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.696 -178.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.426 ' HG3' ' HB3' ' A' ' 137' ' ' ASN . 43.5 mt-10 -87.97 -42.9 12.15 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 122.027 0.917 . . . . 0.0 108.734 177.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -65.9 -28.26 68.81 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.1 -177.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.565 ' HA ' HG21 ' A' ' 85' ' ' ILE . 34.6 m -60.34 -29.15 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-O 121.085 0.469 . . . . 0.0 111.638 177.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -79.93 -44.97 19.38 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-O 121.578 0.704 . . . . 0.0 109.586 178.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.412 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 90.9 mmm -66.6 -44.22 82.69 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 114.866 -1.061 . . . . 0.0 112.653 -176.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.658 ' SD ' ' HA ' ' A' ' 85' ' ' ILE . 28.3 ttt -66.02 -33.77 76.56 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -177.074 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 9.2 t -86.53 0.27 54.66 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.252 0.549 . . . . 0.0 110.696 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -82.74 93.39 7.4 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt . . . . . 0 C--N 1.307 -1.255 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 -178.555 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 30.0 m . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -63.18 -60.21 0.18 Allowed 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.056 1.837 . . . . 0.0 112.03 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -126.03 -50.22 1.57 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 54.27 93.39 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.206 1.402 . . . . 0.0 110.803 -178.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 50.1 m -74.81 24.34 0.09 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -176.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 68.65 -64.53 0.31 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.339 1.455 . . . . 0.0 114.099 176.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -68.0 -21.53 65.04 Favored 'General case' 0 C--O 1.208 -1.096 0 C-N-CA 120.308 -0.557 . . . . 0.0 109.802 -178.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 81' ' ' PHE . . . . . 0.513 ' CE1' ' HB2' ' A' ' 127' ' ' GLU . 40.5 t80 -49.82 -43.5 48.78 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 124.931 1.292 . . . . 0.0 110.549 172.237 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -70.73 -47.15 61.23 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -176.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -60.99 -40.52 93.8 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.598 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.61 -49.75 69.86 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.801 -179.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.402 ' O ' HG12 ' B' ' 89' ' ' ILE . 64.8 m95 -59.71 -39.74 85.63 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.92 177.201 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -53.63 -59.78 4.16 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 122.004 0.907 . . . . 0.0 109.262 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -62.37 -38.0 87.87 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.158 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.08 -51.8 66.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.448 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.402 HG12 ' O ' ' B' ' 85' ' ' TRP . 26.9 pt -66.12 -34.24 68.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.736 -0.386 . . . . 0.0 111.789 -177.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -59.33 -43.89 92.67 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.139 0.495 . . . . 0.0 110.285 175.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.426 ' HG2' ' OE2' ' A' ' 114' ' ' GLU . 5.6 tppp? -75.02 -45.44 41.74 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.312 -178.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.13 -41.62 97.14 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -174.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -64.52 -34.01 77.24 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.282 0.563 . . . . 0.0 110.389 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 94' ' ' HIS . . . . . 0.423 ' HD2' ' O ' ' B' ' 95' ' ' MET . 7.2 t60 -66.97 137.02 56.21 Favored 'General case' 0 CA--C 1.56 1.364 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.176 -176.48 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.518 ' HB3' ' CD ' ' B' ' 96' ' ' PRO . 64.5 mtt -114.75 -157.51 0.03 OUTLIER Pre-proline 0 CA--C 1.573 1.861 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.518 ' CD ' ' HB3' ' B' ' 95' ' ' MET . 17.2 Cg_exo -74.67 19.27 0.47 Allowed 'Trans proline' 0 C--N 1.372 1.78 0 CA-C-N 123.487 2.281 . . . . 0.0 112.11 172.439 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 97' ' ' ASP . . . . . 0.436 ' H ' ' C ' ' B' ' 95' ' ' MET . 8.5 p-10 -104.09 169.38 7.34 Favored Pre-proline 0 C--N 1.308 -1.217 0 C-N-CA 125.067 1.347 . . . . 0.0 109.577 -175.042 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -85.97 93.62 0.6 Allowed 'Trans proline' 0 N--CA 1.435 -1.96 0 C-N-CA 122.347 2.032 . . . . 0.0 109.2 171.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 2.5 t90 -117.76 130.62 56.41 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 107.243 -1.392 . . . . 0.0 107.243 -175.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 100' ' ' ALA . . . . . 0.44 ' HB2' ' CZ ' ' A' ' 68' ' ' PHE . . . . . . . . 0 C--N 1.288 -2.092 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.384 0 CA-C-O 120.195 0.045 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -129.74 98.1 4.71 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.491 ' H ' ' HB1' ' A' ' 73' ' ' ALA . 78.0 mt-30 -135.44 85.91 2.2 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 173.006 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.497 HD23 HG12 ' A' ' 9' ' ' ILE . 6.0 tp -132.96 126.83 32.88 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -177.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 16.7 p -74.64 154.18 38.62 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.515 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.7 mp0 -53.33 -45.23 68.99 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.546 0.738 . . . . 0.0 111.331 -175.146 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -66.3 -34.32 77.73 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.059 0.457 . . . . 0.0 110.685 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 61.9 tp60 -72.23 -36.17 69.05 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.417 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.497 HG12 HD23 ' A' ' 4' ' ' LEU . 62.7 mt -66.64 -34.59 71.07 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.852 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.667 175.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.61 98.91 Favored 'General case' 0 C--O 1.267 2.016 0 C-N-CA 123.128 0.571 . . . . 0.0 110.587 174.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 8' ' ' GLN . 42.6 mm-40 -55.64 -49.06 73.87 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 174.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -68.63 -25.9 65.07 Favored 'General case' 0 C--O 1.187 -2.224 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.311 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 32.9 mmtp -56.48 -56.89 15.59 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 175.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -71.15 -40.77 71.16 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.786 -177.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.424 ' HB1' ' HB1' ' B' ' 100' ' ' ALA . . . -65.13 -30.96 71.93 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.323 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -68.08 -44.48 76.19 Favored 'General case' 0 C--O 1.204 -1.315 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.6 m -63.35 -25.68 68.41 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 120.969 0.414 . . . . 0.0 111.509 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -67.17 -36.99 82.98 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.479 ' CD2' HG21 ' A' ' 35' ' ' VAL . 26.0 m-85 -88.17 -38.41 15.34 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.573 -179.048 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -78.2 99.39 6.21 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 176.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -77.93 -5.23 50.42 Favored 'General case' 0 C--N 1.287 -2.143 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.069 -173.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.639 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 4.1 m-20 -116.98 -13.72 10.63 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.51 53.98 25.49 Favored Glycine 0 CA--C 1.524 0.618 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.881 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.639 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 3.6 m-20 -110.66 -17.79 13.31 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 117.233 0.516 . . . . 0.0 110.241 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.38 21.08 39.09 Favored Glycine 0 N--CA 1.439 -1.165 0 N-CA-C 109.299 -1.521 . . . . 0.0 109.299 -173.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.3 p -146.7 130.98 17.49 Favored 'General case' 0 C--O 1.252 1.229 0 C-N-CA 123.87 0.868 . . . . 0.0 109.613 -178.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 75.1 mt -113.35 121.46 65.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.54 ' OG1' ' HB3' ' A' ' 30' ' ' LYS . 17.9 p -93.83 175.51 6.7 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.282 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.3 p -66.78 -26.58 67.03 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-O 121.316 0.579 . . . . 0.0 109.687 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.54 ' HB3' ' OG1' ' A' ' 28' ' ' THR . 35.4 tttm -49.56 -59.31 3.89 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.401 1.48 . . . . 0.0 109.107 171.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -71.61 -35.77 70.58 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.387 -174.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.5 mt -58.21 -52.04 67.23 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.58 0.55 . . . . 0.0 109.753 175.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.85 -30.13 76.52 Favored Glycine 0 C--O 1.216 -1.0 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.243 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.4 m -59.74 -53.37 58.75 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-O 120.897 0.38 . . . . 0.0 110.624 177.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.482 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 34.2 m -70.28 -34.32 58.02 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.369 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.93 -178.227 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.472 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 49.6 mtt -68.92 -34.94 76.2 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.969 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.0 ttp85 -60.31 -41.9 94.43 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -64.79 -32.3 73.93 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.741 176.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 90.4 mt -84.36 -5.43 59.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.422 -178.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.15 25.46 37.04 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 116.391 -0.368 . . . . 0.0 113.508 178.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -125.59 133.94 52.1 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -120.65 83.65 35.61 Favored Pre-proline 0 C--N 1.301 -1.507 0 O-C-N 122.226 -0.297 . . . . 0.0 110.513 176.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.472 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 6.1 Cg_exo -82.64 154.34 15.62 Favored 'Trans proline' 0 C--O 1.24 0.616 0 C-N-CA 123.121 2.547 . . . . 0.0 111.251 176.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.9 p -86.19 161.74 18.68 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -46.92 -58.96 3.42 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.894 1.678 . . . . 0.0 112.361 -175.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.49 -29.86 70.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 51' ' ' MET . 8.1 mm-40 -68.94 -45.29 71.14 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.1 mt -62.8 -41.2 99.17 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.616 -1.175 . . . . 0.0 109.323 177.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -56.1 -48.09 76.81 Favored 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 123.504 0.722 . . . . 0.0 111.269 176.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -63.66 -37.44 87.36 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 120.613 0.244 . . . . 0.0 111.016 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.602 ' SD ' ' HD2' ' B' ' 96' ' ' PRO . 28.1 mmt -59.59 -48.1 83.0 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.423 HG22 ' HB2' ' A' ' 56' ' ' ASP . 61.1 mt -61.04 -45.28 98.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.153 177.223 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -60.3 -14.84 20.36 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 125.108 1.363 . . . . 0.0 114.49 -176.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -69.76 -39.29 76.8 Favored 'General case' 0 N--CA 1.408 -2.534 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 177.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.717 HG11 ' HB2' ' A' ' 71' ' ' MET . 18.7 m -110.49 -15.86 9.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.028 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.742 -174.006 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.423 ' HB2' HG22 ' A' ' 52' ' ' ILE . 29.9 t0 -71.49 104.91 3.4 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -177.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.41 -26.6 24.65 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.173 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.73 -11.93 38.14 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -176.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 59.63 60.7 8.27 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.787 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -108.03 -17.36 14.06 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.81 23.51 38.63 Favored Glycine 0 N--CA 1.426 -1.986 0 N-CA-C 109.207 -1.557 . . . . 0.0 109.207 -172.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 57.3 p -139.14 136.11 34.77 Favored 'General case' 0 C--O 1.27 2.165 0 C-N-CA 122.593 0.357 . . . . 0.0 110.321 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.422 HG13 HG12 ' A' ' 52' ' ' ILE . 54.6 mt -91.7 104.7 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.127 0 N-CA-C 105.003 -2.221 . . . . 0.0 105.003 174.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -82.49 153.4 25.61 Favored 'General case' 0 C--N 1.285 -2.213 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 -176.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -45.08 -52.73 18.82 Favored Pre-proline 0 N--CA 1.487 1.4 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -176.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -49.54 -42.64 41.72 Favored 'Trans proline' 0 C--N 1.367 1.537 0 C-N-CA 122.842 2.361 . . . . 0.0 112.65 175.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -73.47 -34.09 65.19 Favored 'General case' 0 CA--C 1.508 -0.664 0 C-N-CA 122.884 0.473 . . . . 0.0 110.304 -178.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -62.8 -39.5 94.46 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.14 -47.47 79.83 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.858 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.4 m -57.64 -41.52 81.55 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.418 0.687 . . . . 0.0 110.281 178.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.717 ' HB2' HG11 ' A' ' 55' ' ' VAL . 31.5 ttp -57.58 -45.01 85.78 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.204 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 26.3 mmt -77.42 -38.88 48.72 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.508 -177.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 78' ' ' ASP . . . -59.44 -46.48 88.62 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 123.35 0.407 . . . . 0.0 111.137 179.236 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 66.2 mtp180 -56.42 -31.64 64.1 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.602 0.715 . . . . 0.0 111.758 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -88.13 -25.81 22.8 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.459 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.2 ttp -126.59 109.44 12.12 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.699 -175.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? 77.08 -51.04 0.56 Allowed 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 114.382 1.252 . . . . 0.0 114.382 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.526 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 11.1 t70 -77.98 156.47 30.16 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 178.107 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 41.4 m 61.81 60.97 1.48 Allowed 'General case' 0 CA--C 1.553 1.079 0 CA-C-O 122.603 1.192 . . . . 0.0 109.794 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -94.02 22.85 5.38 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.996 0.903 . . . . 0.0 109.729 -179.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 p -75.2 13.27 0.74 Allowed 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 125.111 1.365 . . . . 0.0 111.806 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 73.47 -1.71 2.97 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 126.274 1.829 . . . . 0.0 111.953 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.1 -46.23 90.3 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -175.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -67.52 -35.9 79.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.036 0.446 . . . . 0.0 110.882 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.9 mm -73.3 -41.68 57.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-O 121.952 0.882 . . . . 0.0 109.217 -176.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -74.25 -34.09 63.5 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.831 -178.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.17 -46.89 88.65 Favored 'General case' 0 CA--C 1.501 -0.905 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.446 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -56.37 -45.77 80.37 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 113.911 -1.495 . . . . 0.0 110.943 177.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -67.21 -45.84 75.64 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 119.739 -0.784 . . . . 0.0 110.863 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -67.07 -22.56 65.84 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -177.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 88' ' ' ALA . 8.1 p -78.88 -21.65 12.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 C-N-CA 119.771 -0.771 . . . . 0.0 110.067 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -94.47 -39.24 10.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.48 175.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -109.27 92.65 4.13 Favored 'General case' 0 C--O 1.245 0.823 0 CA-C-O 121.8 0.81 . . . . 0.0 109.589 174.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -51.47 9.73 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 114.06 -1.427 . . . . 0.0 111.899 -174.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -85.4 -12.37 52.24 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -171.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.23 55.12 1.75 Allowed Glycine 0 N--CA 1.432 -1.612 0 C-N-CA 119.771 -1.204 . . . . 0.0 110.997 177.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -83.21 -18.38 39.5 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.58 -15.54 40.71 Favored Glycine 0 CA--C 1.501 -0.803 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.595 175.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.622 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 73.0 m-85 -140.04 134.4 31.34 Favored 'General case' 0 N--CA 1.417 -2.079 0 N-CA-C 107.275 -1.379 . . . . 0.0 107.275 -179.11 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.417 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.0 mt -75.27 135.52 27.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.713 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 177.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.5 m -105.97 139.58 40.29 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -177.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.55 -47.7 80.52 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.613 0.598 . . . . 0.0 112.613 -175.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.6 -43.14 97.77 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.675 -178.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -66.09 -40.86 91.14 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.099 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.511 ' O ' ' HG2' ' A' ' 109' ' ' MET . 7.0 tt -62.59 -39.28 93.22 Favored 'General case' 0 C--O 1.215 -0.75 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.441 ' HG3' HG11 ' A' ' 121' ' ' VAL . 27.8 ttt180 -68.34 -30.37 69.31 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.305 0.574 . . . . 0.0 109.943 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -69.88 -45.04 68.55 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.736 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.585 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.7 p -64.59 -29.23 46.78 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.471 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.511 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 19.3 mmt -59.53 -49.61 77.13 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 177.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 23.0 m -60.09 -34.77 73.92 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 121.001 0.429 . . . . 0.0 110.061 177.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -70.77 -33.49 70.83 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.087 0.555 . . . . 0.0 110.906 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 72.6 mt -81.4 -8.17 59.69 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.335 0.588 . . . . 0.0 110.565 -178.519 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.36 19.45 30.2 Favored Glycine 0 N--CA 1.432 -1.612 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.996 179.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -98.55 177.02 5.46 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -151.28 48.07 0.83 Allowed 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.928 0.871 . . . . 0.0 109.162 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.413 HD12 ' HG3' ' A' ' 109' ' ' MET . 82.2 mt -76.16 143.99 40.83 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.186 -176.054 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 44.4 p -78.0 170.61 16.31 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.256 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.459 ' HA ' HG22 ' A' ' 121' ' ' VAL . 3.7 p-10 -70.17 -20.65 63.12 Favored 'General case' 0 C--O 1.206 -1.234 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.907 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -71.39 -45.05 63.78 Favored 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 123.485 0.491 . . . . 0.0 110.28 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -65.24 -45.3 85.18 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.964 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.459 HG22 ' HA ' ' A' ' 118' ' ' ASP . 12.8 m -72.57 -27.89 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.39 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.62 -46.29 79.84 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.664 174.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -64.1 -34.19 77.48 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.556 -177.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 65.2 mtt -57.7 -57.72 11.51 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.179 175.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.5 mm -61.56 -56.43 17.84 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.186 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.857 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 -53.01 -44.06 67.0 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 124.909 1.283 . . . . 0.0 113.285 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.645 ' HB2' ' CE1' ' B' ' 81' ' ' PHE . 59.2 mm-40 -87.06 -7.77 57.75 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.957 -175.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -95.43 -30.79 13.7 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 173.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -66.21 102.37 0.83 Allowed 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 125.772 1.629 . . . . 0.0 109.013 173.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.4 mt -81.76 -44.65 20.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.766 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.941 -174.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -73.73 -11.58 60.44 Favored 'General case' 0 C--O 1.243 0.717 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.43 44.72 20.87 Favored Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.51 -0.853 . . . . 0.0 111.252 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -98.03 -16.18 19.73 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.106 0.479 . . . . 0.0 110.126 -177.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.52 4.27 64.13 Favored Glycine 0 C--O 1.241 0.571 0 C-N-CA 120.463 -0.875 . . . . 0.0 111.107 -177.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.622 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 41.7 mt-30 -137.73 151.61 48.38 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.417 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.3 p -114.7 116.33 52.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 C-N-CA 119.898 -0.721 . . . . 0.0 112.893 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.431 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 27.9 t30 -75.55 157.57 33.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.311 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -50.52 -49.04 56.78 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.359 1.064 . . . . 0.0 110.726 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -64.02 -24.73 67.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.985 -177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -85.1 -42.21 15.01 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -63.25 -44.62 94.65 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.431 178.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.92 -30.19 49.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.68 0.276 . . . . 0.0 111.735 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -71.15 -44.06 66.31 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 121.614 0.721 . . . . 0.0 109.935 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 12.9 tmm? -75.41 -40.0 58.35 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.342 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.8 ttt -68.25 -26.65 65.79 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -178.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 16.3 p -80.71 -17.08 52.21 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.245 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -101.83 100.21 10.51 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 97.3 mttt . . . . . 0 C--O 1.25 1.098 0 C-N-CA 125.359 1.464 . . . . 0.0 111.675 -178.395 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.436 -1.167 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -73.92 37.11 0.42 Allowed 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 123.698 2.932 . . . . 0.0 112.64 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -131.97 31.16 4.21 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.466 -175.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -94.31 -44.31 8.0 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 174.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 49.9 m -105.19 -10.87 16.83 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.284 174.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 60.33 29.53 19.08 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.4 1.08 . . . . 0.0 111.316 175.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -141.39 15.23 2.2 Favored 'General case' 0 C--O 1.208 -1.109 0 C-N-CA 118.785 -1.166 . . . . 0.0 111.466 -173.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 81' ' ' PHE . . . . . 0.645 ' CE1' ' HB2' ' A' ' 127' ' ' GLU . 49.6 t80 -48.93 -58.59 4.62 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 115.429 1.64 . . . . 0.0 115.429 -175.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 82' ' ' LYS . . . . . 0.407 ' HD3' ' HA ' ' B' ' 82' ' ' LYS . 56.3 mmtt -75.1 -36.78 61.67 Favored 'General case' 0 CA--C 1.496 -1.127 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -175.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.76 -31.41 72.37 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 123.703 0.627 . . . . 0.0 109.346 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.79 -56.11 9.06 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.592 177.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 49.3 m95 -59.43 -42.05 90.97 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 86' ' ' LYS . . . . . 0.461 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.7 OUTLIER -52.43 -60.48 3.18 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.339 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -56.13 -47.7 77.65 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.506 -1.679 . . . . 0.0 111.159 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.66 -59.67 4.58 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 123.421 0.688 . . . . 0.0 112.81 -176.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 86.9 mt -54.51 -51.27 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 O-C-N 123.793 0.683 . . . . 0.0 111.839 -174.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 90' ' ' GLN . . . . . 0.415 ' OE1' ' HE2' ' B' ' 86' ' ' LYS . 49.1 mt-30 -62.66 -44.27 96.69 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.096 -174.522 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.526 ' HA ' ' O ' ' B' ' 94' ' ' HIS 0.296 19.4 ptmt -81.62 -19.67 41.33 Favored 'General case' 0 C--O 1.21 -0.998 0 C-N-CA 119.256 -0.978 . . . . 0.0 113.447 179.627 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.37 -38.45 81.41 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.453 -0.779 . . . . 0.0 109.216 173.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -74.18 -32.67 63.18 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.601 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 94' ' ' HIS . . . . . 0.526 ' O ' ' HA ' ' B' ' 91' ' ' LYS . 58.1 m170 -140.05 103.04 4.53 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 174.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.549 ' HB2' ' HD3' ' B' ' 96' ' ' PRO . 1.5 mpt? -53.29 -50.78 80.67 Favored Pre-proline 0 N--CA 1.473 0.701 0 O-C-N 123.39 0.431 . . . . 0.0 110.885 -178.157 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.602 ' HD2' ' SD ' ' A' ' 51' ' ' MET . 11.4 Cg_endo -99.29 95.06 0.05 OUTLIER 'Trans proline' 0 N--CA 1.425 -2.513 0 C-N-CA 122.175 1.917 . . . . 0.0 110.057 169.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -110.38 132.27 21.6 Favored Pre-proline 0 C--N 1.307 -1.272 0 C-N-CA 120.511 -0.475 . . . . 0.0 111.506 -176.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.44 64.09 8.49 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.013 2.476 . . . . 0.0 110.667 174.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -72.02 88.79 1.09 Allowed 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.749 -176.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 100' ' ' ALA . . . . . 0.424 ' HB1' ' HB1' ' A' ' 15' ' ' ALA . . . . . . . . 0 C--N 1.311 -1.099 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.618 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.384 0 CA-C-O 120.812 0.339 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.445 ' OD1' ' HA ' ' A' ' 70' ' ' THR . 25.0 m-20 -86.34 111.02 20.08 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-O 121.141 0.496 . . . . 0.0 109.769 -175.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -87.57 77.28 8.79 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.566 HD23 HG12 ' A' ' 9' ' ' ILE . 14.2 tp -118.85 142.49 47.68 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -176.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.606 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 38.2 p -72.67 142.9 48.26 Favored 'General case' 0 N--CA 1.427 -1.6 0 C-N-CA 119.223 -0.991 . . . . 0.0 108.864 176.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -71.58 -18.05 62.26 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 112.98 0.734 . . . . 0.0 112.98 -172.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -71.05 -36.52 72.34 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.606 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 6.8 mm100 -70.11 -39.89 75.22 Favored 'General case' 0 C--O 1.196 -1.743 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 177.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.566 HG12 HD23 ' A' ' 4' ' ' LEU . 32.0 mt -59.93 -39.11 79.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.039 176.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.88 -47.26 85.8 Favored 'General case' 0 C--O 1.246 0.914 0 C-N-CA 123.308 0.643 . . . . 0.0 111.064 176.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.428 ' OE1' ' HB3' ' A' ' 148' ' ' LYS . 32.3 tt0 -63.46 -42.09 98.61 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.801 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.56 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 14.9 m-30 -65.37 -34.72 78.97 Favored 'General case' 0 C--O 1.187 -2.212 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.085 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 97.3 mttt -57.03 -43.45 81.89 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.245 0.341 . . . . 0.0 110.89 174.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -59.68 -61.15 2.83 Favored 'General case' 0 C--O 1.258 1.509 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.576 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.64 -26.56 67.86 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.797 -177.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.56 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 30.9 t80 -61.37 -47.6 85.11 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 123.332 0.653 . . . . 0.0 110.503 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.1 m -75.28 -16.93 60.4 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.164 0.507 . . . . 0.0 110.977 178.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.34 -36.64 79.56 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 172.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -84.25 -41.79 16.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.025 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -80.74 99.14 8.07 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -73.6 -1.68 19.8 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -116.75 -14.38 10.77 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 117.996 -1.482 . . . . 0.0 112.014 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.53 28.34 33.02 Favored Glycine 0 C--N 1.309 -0.929 0 C-N-CA 120.28 -0.962 . . . . 0.0 112.637 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -101.2 -17.44 16.62 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.197 0.523 . . . . 0.0 109.788 178.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.58 20.45 76.64 Favored Glycine 0 N--CA 1.437 -1.262 0 CA-C-N 115.537 -0.756 . . . . 0.0 114.733 176.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.6 p -132.04 128.69 38.82 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 171.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.7 mt -104.31 115.75 46.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.846 0 O-C-N 121.873 -0.517 . . . . 0.0 109.731 -174.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -83.61 173.35 11.48 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.043 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.1 p -61.87 -43.05 99.64 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 120.864 0.364 . . . . 0.0 111.022 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -64.91 -35.08 79.99 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.656 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.77 -45.35 68.23 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.083 177.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.9 mt -54.59 -55.72 26.47 Favored 'General case' 0 C--O 1.201 -1.477 0 O-C-N 124.133 0.895 . . . . 0.0 110.723 177.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.25 -31.69 77.96 Favored Glycine 0 CA--C 1.522 0.508 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.486 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.3 m -70.95 -48.77 51.62 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 117.285 0.542 . . . . 0.0 110.686 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.4 m -68.39 -35.11 69.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.637 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.238 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.422 ' HB3' ' HB3' ' A' ' 41' ' ' GLN . 64.5 mtt -65.82 -33.03 74.92 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.149 177.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -62.67 -41.94 99.35 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -68.23 -20.43 64.82 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.706 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.457 ' C ' ' HD2' ' B' ' 91' ' ' LYS . 4.3 mm? -101.0 13.85 33.87 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.048 0.452 . . . . 0.0 112.152 177.181 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.97 26.98 61.15 Favored Glycine 0 C--O 1.241 0.575 0 N-CA-C 114.564 0.586 . . . . 0.0 114.564 173.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.422 ' HB3' ' HB3' ' A' ' 36' ' ' MET . 10.4 tt0 -127.07 124.41 39.19 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -179.246 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -119.27 78.01 18.22 Favored Pre-proline 0 C--N 1.298 -1.639 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.475 ' HG2' HD21 ' A' ' 48' ' ' LEU . 38.9 Cg_endo -89.31 160.09 5.59 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 122.29 1.993 . . . . 0.0 112.1 -179.68 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 39.6 p -80.85 159.98 24.9 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.68 -26.59 68.45 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 120.687 0.28 . . . . 0.0 110.656 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.68 -46.92 85.95 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.105 0.479 . . . . 0.0 110.037 175.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -66.6 -35.02 79.18 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.331 178.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.475 HD21 ' HG2' ' A' ' 43' ' ' PRO . 97.1 mt -66.01 -49.87 66.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.983 177.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -58.43 -43.68 88.81 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 122.959 0.503 . . . . 0.0 110.789 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -65.32 -40.77 94.14 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.083 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.8 tpt -62.27 -42.34 99.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.426 0.631 . . . . 0.0 109.582 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 48' ' ' LEU . 79.5 mt -62.21 -48.98 85.88 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.922 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.913 177.054 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -52.5 -37.09 56.63 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -174.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -66.43 -28.33 68.52 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.09 -1.044 . . . . 0.0 111.637 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.587 HG11 ' HB2' ' A' ' 71' ' ' MET . 7.8 m -101.58 -20.84 5.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.565 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.407 ' HB2' HG22 ' A' ' 52' ' ' ILE . 31.8 t0 -72.59 111.81 8.09 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 123.904 0.882 . . . . 0.0 111.182 -174.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.87 -16.05 37.22 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.604 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -98.19 -12.42 21.71 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 -177.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.11 31.91 62.42 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -173.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.3 p-10 -98.31 -5.42 32.97 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -172.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.58 23.55 39.2 Favored Glycine 0 N--CA 1.44 -1.05 0 C-N-CA 120.087 -1.054 . . . . 0.0 112.458 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.24 139.95 30.46 Favored 'General case' 0 C--O 1.253 1.279 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 178.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 65.2 mt -92.66 111.75 24.95 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -85.41 166.11 16.66 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.438 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 70.7 t80 -56.17 -53.63 61.47 Favored Pre-proline 0 CA--C 1.554 1.127 0 O-C-N 123.425 0.453 . . . . 0.0 112.114 179.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -51.94 -37.35 66.99 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.927 2.418 . . . . 0.0 112.383 175.463 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -74.55 -33.55 62.75 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.458 0.647 . . . . 0.0 110.3 -177.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -68.21 -36.8 80.1 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 87.3 mt -61.73 -47.04 87.05 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.396 175.513 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.445 ' HA ' ' OD1' ' A' ' 2' ' ' ASP . 55.8 m -56.24 -47.02 79.33 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 123.764 0.665 . . . . 0.0 110.827 177.178 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.587 ' HB2' HG11 ' A' ' 55' ' ' VAL . 28.3 ttp -57.58 -42.25 82.76 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 123.205 0.602 . . . . 0.0 111.551 179.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 25.1 mmt -75.28 -44.92 43.11 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.434 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.26 77.48 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.927 0.394 . . . . 0.0 110.227 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -63.87 -46.49 84.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.582 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -62.24 -51.74 66.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.394 -175.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.0 ttm -56.05 -43.32 77.77 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 125.169 1.388 . . . . 0.0 112.528 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 50.3 tttp -89.15 -24.82 22.11 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.895 -174.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -80.77 -58.8 2.93 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-O 121.855 0.836 . . . . 0.0 112.049 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.2 t -101.49 88.71 3.51 Favored 'General case' 0 C--N 1.245 -3.977 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.693 -177.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -117.72 0.41 12.0 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.638 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.9 m -77.89 35.82 0.21 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 123.71 0.804 . . . . 0.0 112.614 -173.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 61.47 16.48 7.58 Favored 'General case' 0 C--O 1.209 -1.063 0 C-N-CA 123.916 0.886 . . . . 0.0 110.937 -177.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -70.25 -56.39 6.89 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 116.891 -0.14 . . . . 0.0 111.053 -172.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -63.61 -28.75 70.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.806 0.813 . . . . 0.0 109.878 178.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.5 mm -70.96 -52.74 25.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-N 114.464 -1.243 . . . . 0.0 109.646 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 35.4 ttm180 -71.31 -35.83 71.39 Favored 'General case' 0 C--O 1.204 -1.304 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.13 -176.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -58.26 -37.59 75.24 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 123.257 0.348 . . . . 0.0 111.502 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -70.25 -39.23 75.15 Favored 'General case' 0 C--O 1.211 -0.923 0 O-C-N 123.484 0.49 . . . . 0.0 110.849 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -71.52 -45.39 62.52 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.457 0.646 . . . . 0.0 109.899 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -64.3 -28.3 69.62 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 125.824 1.65 . . . . 0.0 111.974 -176.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 88' ' ' ALA . 8.4 p -77.81 -22.61 13.9 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.877 -179.155 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -89.3 -56.81 3.12 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 174.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 97' ' ' ASN . 16.2 t0 -91.4 80.95 5.45 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 122.136 0.97 . . . . 0.0 109.159 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.614 ' HD2' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -78.53 -30.17 46.88 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.51 -1.223 . . . . 0.0 113.572 -175.688 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.8 -13.49 59.38 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.516 0.674 . . . . 0.0 110.612 -178.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.62 76.16 0.8 Allowed Glycine 0 N--CA 1.438 -1.202 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.01 177.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.402 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 35.5 m-80 -110.72 -19.25 12.92 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.199 0.523 . . . . 0.0 109.854 178.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.62 0.98 87.78 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.91 176.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -141.31 145.44 35.48 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -178.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.48 ' HB ' HG13 ' A' ' 136' ' ' VAL . 1.8 mt -105.5 113.54 42.68 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 174.235 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.6 m -96.46 156.58 16.28 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.88 -39.95 96.04 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 117.748 0.249 . . . . 0.0 111.04 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.51 -44.44 96.01 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 123.399 0.437 . . . . 0.0 110.569 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -65.39 -49.74 68.15 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.277 177.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.462 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.3 tm? -60.79 -40.57 93.14 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 115.305 -0.862 . . . . 0.0 108.746 -174.145 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.451 ' HB2' HG21 ' A' ' 121' ' ' VAL . 0.7 OUTLIER -59.47 -47.14 86.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 176.25 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -55.49 -52.73 62.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.725 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.708 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.8 p -66.2 -37.63 80.16 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.553 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.358 -177.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.9 mmt -60.69 -41.32 94.94 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.7 m -58.82 -41.31 86.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 175.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -74.49 -24.02 58.95 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.443 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.708 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 84.1 mt -87.61 -19.62 27.53 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.097 0.475 . . . . 0.0 110.098 -178.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 83.19 35.05 19.09 Favored Glycine 0 N--CA 1.43 -1.745 0 C-N-CA 120.892 -0.671 . . . . 0.0 111.543 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -98.83 132.95 43.79 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -84.5 46.22 1.21 Allowed 'General case' 0 C--N 1.292 -1.935 0 C-N-CA 123.473 0.709 . . . . 0.0 110.951 -176.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.419 HD12 ' HG3' ' A' ' 109' ' ' MET . 38.2 mt -86.2 129.52 34.82 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.7 p -79.01 168.44 19.68 Favored 'General case' 0 C--N 1.297 -1.704 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.479 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.51 -50.73 71.54 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -176.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.413 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 1.4 mp0 -60.38 -32.87 71.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.486 0.66 . . . . 0.0 109.719 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -71.52 -43.42 66.49 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.873 -178.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.5 m -68.98 -32.55 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 177.198 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -67.23 -45.57 76.35 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.529 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -72.06 -32.59 67.22 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.687 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.5 tpp -53.28 -49.22 67.4 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 172.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.0 mm -67.15 -48.33 79.01 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.208 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.531 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -57.67 -33.75 68.67 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.702 0.801 . . . . 0.0 112.259 -175.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -82.76 -23.82 33.78 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.163 0.506 . . . . 0.0 111.189 -178.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -87.98 -24.05 23.65 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.668 0.746 . . . . 0.0 109.522 177.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.482 ' OD2' ' HA2' ' A' ' 132' ' ' GLY . 5.0 t70 -69.96 99.72 1.47 Allowed 'General case' 0 C--N 1.309 -1.152 0 C-N-CA 125.825 1.65 . . . . 0.0 109.763 175.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.6 mt -82.33 -47.76 18.73 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -73.84 -10.68 59.91 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 121.203 0.525 . . . . 0.0 110.997 -176.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.482 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 72.56 52.21 10.6 Favored Glycine 0 N--CA 1.437 -1.286 0 N-CA-C 110.282 -1.127 . . . . 0.0 110.282 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -106.46 -17.37 14.29 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -177.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.64 -9.37 52.3 Favored Glycine 0 N--CA 1.437 -1.251 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.245 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -133.3 137.3 45.92 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 -178.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.48 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.3 p -88.14 116.92 30.87 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 CA-C-O 121.589 0.709 . . . . 0.0 110.469 177.063 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -84.5 159.58 20.7 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 114.832 -1.077 . . . . 0.0 109.819 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.494 ' O ' HG13 ' A' ' 142' ' ' VAL . 77.0 t80 -54.85 -46.74 74.71 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 123.858 0.863 . . . . 0.0 111.328 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.2 -22.34 65.84 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -87.77 -43.3 11.97 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.57 -35.47 81.09 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.941 -178.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 138' ' ' TYR . 32.6 m -58.38 -35.89 56.07 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.924 0 CA-C-O 120.933 0.397 . . . . 0.0 110.908 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -75.43 -21.05 58.48 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.41 -178.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 92.4 mmm -76.98 -35.42 57.2 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 90.6 mmm -73.6 -23.87 59.97 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 113.455 -1.702 . . . . 0.0 110.362 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 22.6 m -88.22 -6.45 57.81 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 121.263 0.554 . . . . 0.0 110.346 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -81.57 45.36 0.87 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.373 0.606 . . . . 0.0 111.905 -176.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.499 ' HA ' ' NZ ' ' B' ' 82' ' ' LYS . 7.7 mtpm? . . . . . 0 C--N 1.304 -1.405 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 74' ' ' SER . . . . . 0.407 ' HA ' ' HD3' ' B' ' 75' ' ' PRO . 48.1 t . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 75' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' B' ' 74' ' ' SER . 15.3 Cg_exo -74.99 -8.31 19.96 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 122.409 2.073 . . . . 0.0 111.045 174.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.6 163.27 14.18 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.376 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -119.56 131.36 55.51 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.5 m -58.11 -39.83 79.65 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 122.486 0.314 . . . . 0.0 110.856 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -73.58 -22.14 60.14 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -76.93 -35.74 57.1 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 178.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -79.67 -23.22 42.63 Favored 'General case' 0 C--O 1.196 -1.713 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.899 174.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 82' ' ' LYS . . . . . 0.522 ' O ' ' HG3' ' B' ' 86' ' ' LYS . 87.4 tttt -60.63 -33.96 73.54 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 173.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -59.8 -50.93 71.9 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 176.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.46 -41.81 98.62 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 113.468 -1.696 . . . . 0.0 111.303 177.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.401 ' O ' HG12 ' B' ' 89' ' ' ILE . 74.1 m95 -58.02 -36.43 72.69 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 177.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 86' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' B' ' 82' ' ' LYS . 89.1 mttt -52.6 -34.88 52.84 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.483 0.658 . . . . 0.0 110.171 177.087 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -85.02 -54.28 4.75 Favored 'General case' 0 C--O 1.205 -1.283 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.891 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.0 -51.63 51.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.904 0.882 . . . . 0.0 112.748 -176.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.44 HD12 ' HB1' ' A' ' 88' ' ' ALA . 50.4 mm -61.32 -53.35 49.9 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.427 0 CA-C-O 121.543 0.687 . . . . 0.0 109.604 -179.119 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -69.31 -32.43 71.56 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.624 -1.171 . . . . 0.0 112.173 -171.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.457 ' HD2' ' C ' ' A' ' 39' ' ' LEU . 22.3 tptm -67.71 -39.44 84.35 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.373 0.669 . . . . 0.0 109.699 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.446 ' HA ' HD22 ' A' ' 112' ' ' LEU . . . -82.42 -51.45 7.83 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.79 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -61.98 -29.46 70.27 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.953 -177.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 12.0 t60 63.81 77.84 0.31 Allowed 'General case' 0 C--N 1.344 0.349 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 83.2 mtp -101.52 120.15 55.39 Favored Pre-proline 0 C--N 1.301 -1.529 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.469 -173.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -70.11 -19.66 34.15 Favored 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 122.686 2.257 . . . . 0.0 110.401 173.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -99.75 116.23 64.95 Favored Pre-proline 0 N--CA 1.436 -1.148 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.353 175.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -58.0 116.46 3.25 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 122.731 2.287 . . . . 0.0 110.252 178.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -81.09 113.62 19.39 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.155 -172.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.421 -1.875 0 CA-C-N 114.328 -1.306 . . . . 0.0 107.712 177.942 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.304 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 22.0 t70 67.69 -73.18 0.08 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.141 0.976 . . . . 0.0 112.978 177.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -82.93 117.31 22.68 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 -177.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.409 ' HB3' HD11 ' A' ' 9' ' ' ILE . 13.3 tp -103.76 160.42 14.79 Favored 'General case' 0 N--CA 1.423 -1.811 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -177.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.7 p -90.64 157.02 17.7 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 122.848 0.459 . . . . 0.0 111.372 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -51.29 -49.84 60.48 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 -174.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -40.67 95.95 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -176.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -67.27 -44.05 80.3 Favored 'General case' 0 C--O 1.211 -0.931 0 O-C-N 123.52 0.513 . . . . 0.0 110.015 176.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.519 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 78.5 mt -62.52 -42.4 95.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.614 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.41 -35.76 81.12 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-O 121.555 0.693 . . . . 0.0 110.205 178.232 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -63.27 -49.99 71.92 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.923 178.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.464 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 42.1 m-85 -71.12 -24.0 62.2 Favored 'General case' 0 C--O 1.177 -2.759 0 CA-C-N 114.88 -1.054 . . . . 0.0 112.459 -179.187 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.1 mttt -62.95 -40.92 99.12 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 119.056 0.843 . . . . 0.0 110.023 174.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -58.81 -56.38 22.95 Favored 'General case' 0 C--O 1.25 1.1 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.119 178.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.455 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -72.61 -23.76 60.98 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.281 -176.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.464 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 47.5 t80 -64.84 -44.34 90.13 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 177.323 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.8 t -75.76 -16.94 60.06 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.864 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.455 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 38.6 tp -72.18 -41.51 66.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.054 174.536 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.442 ' CE1' ' HA ' ' B' ' 100' ' ' ALA . 21.7 m-85 -80.41 -40.45 26.41 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.223 178.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -72.44 99.05 2.38 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.464 ' HE2' HG12 ' A' ' 35' ' ' VAL . 56.3 mttm -83.63 1.73 40.89 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -174.205 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.578 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 10.4 m-20 -105.68 -13.9 15.42 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.533 179.349 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.92 34.52 55.77 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.85 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.578 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 2.6 p30 -113.29 -16.88 12.44 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -178.577 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.73 33.6 33.6 Favored Glycine 0 C--N 1.311 -0.809 0 N-CA-C 114.999 0.76 . . . . 0.0 114.999 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.7 p -149.28 129.04 13.27 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 171.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 60.0 mt -99.18 120.19 48.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-O 121.298 0.571 . . . . 0.0 112.074 -170.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.0 p -93.45 175.18 6.85 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.993 178.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 46.2 p -67.58 -25.52 65.82 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.493 0.664 . . . . 0.0 109.734 176.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -57.89 -57.05 14.48 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.014 175.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -65.11 -40.73 94.94 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.373 -177.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.7 -52.55 64.99 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 123.488 0.492 . . . . 0.0 110.547 175.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.79 -31.05 78.59 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.312 -0.947 . . . . 0.0 112.798 -178.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.0 m -72.74 -43.22 63.19 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 117.467 0.634 . . . . 0.0 111.226 178.34 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.616 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 35.0 m -67.43 -36.06 75.31 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.422 176.766 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.47 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 66.2 mtt -67.48 -35.09 78.49 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.187 177.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -61.1 -38.72 87.28 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.3 t -72.02 -28.3 63.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.809 177.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 80.4 mt -78.91 -20.15 50.09 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.881 0.372 . . . . 0.0 110.505 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.37 32.46 7.36 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 121.373 -0.442 . . . . 0.0 112.27 179.049 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -145.18 139.53 27.3 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 -126.25 80.03 69.21 Favored Pre-proline 0 C--N 1.3 -1.573 0 O-C-N 121.773 -0.579 . . . . 0.0 112.403 -179.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.47 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 21.9 Cg_exo -69.82 149.43 66.53 Favored 'Trans proline' 0 C--O 1.242 0.705 0 C-N-CA 121.82 1.68 . . . . 0.0 109.447 173.066 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.1 p -78.95 162.53 25.92 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -174.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -44.49 -56.44 4.29 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 126.162 1.785 . . . . 0.0 113.657 -174.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.95 -34.52 76.74 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -175.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -60.78 -45.47 94.23 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.434 ' O ' HG13 ' A' ' 52' ' ' ILE . 96.7 mt -60.83 -43.19 98.59 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.991 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -73.55 -31.78 63.84 Favored 'General case' 0 N--CA 1.44 -0.927 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.448 -178.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.501 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 31.2 t70 -67.27 -40.06 86.12 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 119.719 -0.792 . . . . 0.0 109.577 175.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.8 tpt -59.37 -37.2 77.3 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.368 175.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 48' ' ' LEU . 45.5 mt -66.41 -50.93 63.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.725 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.772 174.37 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -59.81 -23.12 63.07 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 124.016 0.926 . . . . 0.0 112.724 -173.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 17.0 mm-40 -62.0 -36.94 83.02 Favored 'General case' 0 N--CA 1.396 -3.143 0 C-N-CA 124.479 1.112 . . . . 0.0 111.164 175.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.544 HG11 ' SD ' ' A' ' 71' ' ' MET . 28.9 m -109.02 -14.41 10.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.761 0.315 . . . . 0.0 111.383 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -72.61 114.14 10.42 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.72 -18.91 30.02 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.964 -177.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -97.12 -12.37 23.21 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.57 37.06 88.03 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 -174.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.0 p-10 -101.49 -7.65 22.65 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.36 18.37 28.75 Favored Glycine 0 N--CA 1.436 -1.324 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.937 173.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 p -143.64 142.48 31.04 Favored 'General case' 0 C--O 1.253 1.276 0 CA-C-N 116.731 0.265 . . . . 0.0 110.436 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.9 mt -92.19 108.89 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.64 169.7 15.96 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.437 ' CE2' HD11 ' A' ' 69' ' ' LEU . 52.6 t80 -58.59 -55.88 41.32 Favored Pre-proline 0 CA--C 1.554 1.11 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -176.149 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.01 -37.08 78.3 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.498 2.132 . . . . 0.0 112.117 176.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -70.25 -39.84 74.79 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.009 0.433 . . . . 0.0 110.433 -178.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' B' ' 100' ' ' ALA . 3.2 t80 -66.08 -39.85 90.36 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.437 HD11 ' CE2' ' A' ' 65' ' ' PHE . 83.4 mt -65.35 -45.24 84.95 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.354 177.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 89.1 m -56.96 -44.71 82.87 Favored 'General case' 0 C--O 1.239 0.535 0 O-C-N 123.466 0.479 . . . . 0.0 109.976 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.544 ' SD ' HG11 ' A' ' 55' ' ' VAL . 32.5 ttp -58.9 -49.13 78.95 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.879 177.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.5 mmt -62.52 -43.84 97.84 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.73 -24.69 66.97 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.087 0.47 . . . . 0.0 111.476 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.9 mtp180 -82.77 -41.54 19.05 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.386 0.613 . . . . 0.0 109.497 175.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 81' ' ' SER . 59.4 tttp -67.99 -28.71 67.67 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.705 -1.134 . . . . 0.0 111.623 -172.437 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 73.8 mtm -96.16 6.09 49.6 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -133.13 -48.55 0.85 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -178.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -75.11 -77.99 0.11 Allowed 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 122.041 0.924 . . . . 0.0 112.299 -173.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.1 m -147.31 170.91 16.31 Favored 'General case' 0 C--N 1.249 -3.785 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.0 t70 72.89 33.66 1.21 Allowed 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 123.014 1.387 . . . . 0.0 109.147 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.519 ' O ' HG12 ' A' ' 85' ' ' ILE . 22.9 t -120.0 -65.42 1.16 Allowed 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.369 -1.287 . . . . 0.0 109.602 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -63.12 -35.99 82.11 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.526 0.679 . . . . 0.0 110.07 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.55 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 1.6 mp0 -70.23 -33.25 71.43 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.717 178.785 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -64.02 -46.66 83.51 Favored 'General case' 0 CA--C 1.492 -1.266 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.519 HG12 ' O ' ' A' ' 81' ' ' SER . 6.9 mm -64.73 -35.77 75.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 114.759 -1.11 . . . . 0.0 109.311 -176.315 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -64.14 -49.76 70.89 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.444 175.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' A' ' 83' ' ' GLU . 40.4 mm-40 -64.41 -36.15 83.22 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.849 0.356 . . . . 0.0 111.83 -176.713 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.2 -28.06 67.77 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.583 177.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -80.51 -49.55 11.22 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.594 0.712 . . . . 0.0 109.097 176.051 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -53.94 -30.91 48.58 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 126.379 1.872 . . . . 0.0 112.681 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.441 HG21 ' O ' ' B' ' 92' ' ' ALA . 14.2 p -70.8 -29.39 37.51 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.641 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -86.24 -49.47 7.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 176.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -88.44 79.33 7.7 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.975 179.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HE2' ' O ' ' A' ' 91' ' ' VAL . 70.7 mmtt -75.53 -30.55 59.81 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.621 -177.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -85.37 -12.48 52.07 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -177.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.81 51.6 6.29 Favored Glycine 0 CA--C 1.502 -0.733 0 C-N-CA 120.77 -0.729 . . . . 0.0 111.678 177.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -90.31 -17.96 26.43 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 123.073 0.549 . . . . 0.0 110.053 -179.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.15 9.56 79.89 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.456 178.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 39.7 p90 -157.28 156.96 33.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.532 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.0 mt -105.21 134.88 45.44 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.0 t -107.59 151.01 26.19 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 177.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.12 -55.87 29.5 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -175.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.0 -26.94 68.5 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.137 0.494 . . . . 0.0 110.965 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.95 -40.49 65.35 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.515 177.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.492 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.4 tt -63.56 -39.43 94.38 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.628 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.453 ' O ' ' HD2' ' A' ' 106' ' ' ARG . 4.2 tmm_? -66.76 -38.49 86.7 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -59.73 -48.75 80.45 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.048 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.609 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.8 p -65.02 -33.42 63.62 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.298 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.099 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.519 ' HG3' HD12 ' A' ' 116' ' ' LEU . 21.7 mmt -59.72 -45.51 91.96 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-O 120.751 0.31 . . . . 0.0 111.569 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 23.7 m -64.69 -29.75 70.75 Favored 'General case' 0 CA--C 1.563 1.459 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.214 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.73 -24.35 41.68 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.105 0.479 . . . . 0.0 111.091 177.139 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 77.3 mt -89.17 -19.95 24.84 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.722 0.409 . . . . 0.0 111.01 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.27 24.97 9.79 Favored Glycine 0 C--N 1.308 -1.014 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.905 -178.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -111.1 154.44 24.27 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 121.412 0.625 . . . . 0.0 109.5 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -124.09 104.68 9.01 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.207 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.519 HD12 ' HG3' ' A' ' 109' ' ' MET . 61.7 mt -124.52 151.75 44.27 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 35.7 p -86.85 169.63 12.38 Favored 'General case' 0 C--N 1.29 -2.012 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.415 ' HA ' HG22 ' A' ' 121' ' ' VAL . 2.2 m-20 -66.18 -35.13 79.66 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.17 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.96 -43.69 94.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.047 175.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -65.57 -53.65 38.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.885 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.454 ' O ' HG12 ' A' ' 125' ' ' ILE . 23.1 m -65.36 -36.47 77.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.566 -176.279 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -69.08 -34.3 74.91 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 120.893 0.378 . . . . 0.0 110.441 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.41 -40.51 77.25 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.4 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 56.2 mtt -56.62 -50.99 70.37 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.701 176.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.2 mm -58.02 -45.52 88.07 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 O-C-N 123.919 0.762 . . . . 0.0 109.484 178.137 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.6 ttp-105 -58.92 -31.74 68.93 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -176.119 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' A' ' 128' ' ' ALA . 0.4 OUTLIER -79.4 -32.82 43.07 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 117.974 -1.49 . . . . 0.0 109.931 178.357 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.433 ' N ' ' HG3' ' A' ' 127' ' ' GLU . . . -84.75 -24.76 28.67 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.582 -175.223 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -73.51 89.53 1.69 Allowed 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 124.117 0.967 . . . . 0.0 108.584 175.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 84.7 mt -82.84 -35.85 12.69 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.926 -174.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -81.31 -9.29 59.78 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.561 0.696 . . . . 0.0 111.296 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.08 49.57 15.82 Favored Glycine 0 CA--C 1.499 -0.908 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.697 175.159 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -115.47 -16.46 11.38 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-O 121.385 0.612 . . . . 0.0 110.942 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.0 5.35 60.97 Favored Glycine 0 C--N 1.304 -1.205 0 N-CA-C 111.097 -0.801 . . . . 0.0 111.097 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -131.73 125.21 31.43 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.532 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.2 p -94.58 111.28 25.14 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.833 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.357 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -85.85 168.98 13.75 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.431 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.576 ' O ' HG13 ' A' ' 142' ' ' VAL . 92.5 t80 -57.18 -45.77 83.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.103 -176.491 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.471 ' O ' HG22 ' A' ' 142' ' ' VAL . 10.8 pt-20 -61.91 -27.95 69.18 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.31 0.576 . . . . 0.0 111.678 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HG3' ' HG3' ' A' ' 139' ' ' GLU . 38.4 mt-10 -82.39 -41.02 20.47 Favored 'General case' 0 N--CA 1.414 -2.259 0 CA-C-O 122.126 0.965 . . . . 0.0 108.458 -177.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -60.12 -44.65 94.72 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.74 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.576 HG13 ' O ' ' A' ' 138' ' ' TYR . 19.7 m -56.33 -33.85 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 CA-C-O 121.126 0.489 . . . . 0.0 112.193 -177.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -80.09 -50.9 9.68 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.521 -174.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -24.09 63.09 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.408 -176.23 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 25.9 ttt -79.09 -37.71 38.1 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.646 -0.422 . . . . 0.0 112.004 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 7.6 t -83.89 -18.06 38.7 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 119.926 -0.709 . . . . 0.0 110.014 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -118.0 74.4 0.94 Allowed 'General case' 0 N--CA 1.432 -1.349 0 CA-C-O 121.358 0.599 . . . . 0.0 109.553 177.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm . . . . . 0 N--CA 1.419 -2.005 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 178.821 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 N--CA 1.44 -0.934 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -62.54 -55.74 0.83 Allowed 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.091 1.861 . . . . 0.0 110.245 176.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . 52.89 36.02 20.58 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 123.922 0.889 . . . . 0.0 111.367 175.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -72.0 -20.21 61.75 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.9 -173.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -93.52 -3.13 53.42 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 65.58 -64.68 0.18 Allowed 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 115.316 1.598 . . . . 0.0 115.316 176.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -62.71 -21.33 65.69 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 119.074 0.852 . . . . 0.0 112.344 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -64.53 -30.26 71.29 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.321 0.581 . . . . 0.0 111.06 176.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.27 -35.82 74.0 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -71.41 -22.65 61.83 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.11 177.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.57 -44.45 90.67 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.4 ' CZ2' ' HB3' ' A' ' 124' ' ' MET . 52.7 m95 -71.06 -36.06 72.16 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.092 175.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -57.19 -54.08 50.84 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 178.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -59.4 -46.14 89.53 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.573 -1.649 . . . . 0.0 111.104 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.2 -55.84 29.77 Favored 'General case' 0 CA--C 1.503 -0.837 0 O-C-N 123.283 0.364 . . . . 0.0 111.122 -179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.401 ' O ' ' HB2' ' B' ' 93' ' ' LYS . 50.5 mm -60.04 -47.3 92.37 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.711 0 O-C-N 123.524 0.515 . . . . 0.0 110.227 -178.261 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -54.77 -51.98 64.0 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 123.239 0.616 . . . . 0.0 112.141 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.437 ' HA ' HD22 ' A' ' 39' ' ' LEU . 19.8 tptm -69.84 -35.89 75.11 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.097 0.475 . . . . 0.0 111.572 -178.305 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.441 ' O ' HG21 ' A' ' 91' ' ' VAL . . . -77.82 -34.16 52.13 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.237 -177.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 8.1 tmtm? -52.83 -48.81 66.73 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.535 1.134 . . . . 0.0 109.362 -178.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 46.41 69.29 0.49 Allowed 'General case' 0 N--CA 1.486 1.334 0 O-C-N 124.42 1.075 . . . . 0.0 113.049 171.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 67.0 mtt -150.36 156.6 37.09 Favored Pre-proline 0 C--N 1.31 -1.11 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -178.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -75.12 -3.73 14.34 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.438 2.092 . . . . 0.0 112.776 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -75.1 124.33 89.33 Favored Pre-proline 0 C--N 1.318 -0.783 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.129 178.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.62 119.42 6.66 Favored 'Trans proline' 0 C--O 1.251 1.133 0 C-N-CA 123.18 2.587 . . . . 0.0 113.234 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -119.72 163.09 17.95 Favored 'General case' 0 N--CA 1.424 -1.757 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 100' ' ' ALA . . . . . 0.442 ' HA ' ' CE1' ' A' ' 19' ' ' PHE . . . . . . . . 0 N--CA 1.426 -1.643 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 174.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.362 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -138.96 81.68 1.86 Allowed 'General case' 0 C--N 1.297 -1.715 0 CA-C-O 122.527 1.155 . . . . 0.0 109.788 176.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -101.36 96.94 7.5 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.553 ' HG ' ' HB2' ' A' ' 8' ' ' GLN . 9.1 tp -133.3 143.55 49.11 Favored 'General case' 0 N--CA 1.426 -1.635 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -174.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.454 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 71.4 p -84.44 159.2 20.83 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 119.519 -0.872 . . . . 0.0 109.591 177.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.61 -30.76 71.59 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 111.946 0.351 . . . . 0.0 111.946 -175.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.449 ' CD ' ' H ' ' A' ' 7' ' ' GLU . 1.3 mp0 -57.54 -46.11 84.28 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 177.191 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.553 ' HB2' ' HG ' ' A' ' 4' ' ' LEU . 60.3 mm-40 -65.75 -51.72 56.92 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.408 -179.325 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.443 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 78.8 mt -57.83 -36.99 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.73 -176.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' ' 13' ' ' LYS . . . -67.26 -40.84 86.26 Favored 'General case' 0 C--O 1.254 1.29 0 CA-C-O 121.594 0.711 . . . . 0.0 110.6 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -64.64 -40.81 96.1 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.375 -0.83 . . . . 0.0 108.995 176.077 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.406 ' CE2' HD21 ' A' ' 4' ' ' LEU . 36.4 m-85 -60.8 -38.16 84.42 Favored 'General case' 0 C--O 1.162 -3.516 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.307 174.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 10' ' ' ALA . 32.8 mmtp -52.46 -56.47 14.85 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-N 118.318 0.508 . . . . 0.0 111.155 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -64.85 -51.27 62.99 Favored 'General case' 0 C--O 1.25 1.113 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.18 -37.55 87.87 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.996 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -59.8 -42.63 93.85 Favored 'General case' 0 C--O 1.206 -1.205 0 C-N-CA 123.489 0.716 . . . . 0.0 110.272 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.8 m -68.32 -23.69 64.75 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 123.516 0.51 . . . . 0.0 110.742 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.7 tt -73.27 -31.25 63.96 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 121.365 0.602 . . . . 0.0 109.441 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -87.71 -33.04 18.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.475 179.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -79.52 90.61 5.1 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -64.47 -47.06 80.39 Favored 'General case' 0 N--CA 1.428 -1.546 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 -170.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.429 ' OD2' ' HB3' ' A' ' 24' ' ' ASP . 6.7 p-10 -83.2 -13.23 55.84 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.161 -178.112 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.64 58.5 6.35 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 116.008 -0.542 . . . . 0.0 113.145 177.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.429 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 4.8 p-10 -113.62 -15.91 12.43 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 120.991 0.424 . . . . 0.0 110.064 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.33 10.49 38.76 Favored Glycine 0 N--CA 1.43 -1.732 0 CA-C-N 115.962 -0.563 . . . . 0.0 113.955 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 71.2 p -136.75 160.53 38.58 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 118.02 0.91 . . . . 0.0 108.987 175.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.0 mt -120.96 120.4 62.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.152 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.6 p -95.13 175.41 6.63 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.616 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -59.2 -42.75 91.66 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 123.605 0.762 . . . . 0.0 110.606 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -58.73 -44.76 90.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.888 178.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -67.48 -38.69 84.76 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.772 -179.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.23 -46.71 89.27 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.146 176.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.4 -25.19 75.71 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.443 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.9 m -66.71 -54.55 21.77 Favored 'General case' 0 C--O 1.251 1.162 0 CA-C-O 121.31 0.576 . . . . 0.0 109.633 176.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 28.2 m -67.34 -36.13 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.145 -178.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.411 ' HB3' ' O ' ' A' ' 41' ' ' GLN . 49.7 mtt -66.48 -44.4 82.79 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 177.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -59.46 -36.38 75.86 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.0 t -67.62 -14.0 62.56 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.005 179.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 59.6 mt -103.2 -11.57 17.92 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.327 177.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.09 -7.07 32.7 Favored Glycine 0 C--N 1.311 -0.851 0 C-N-CA 120.091 -1.052 . . . . 0.0 114.122 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.48 ' NE2' ' HB3' ' B' ' 96' ' ' PRO . 0.0 OUTLIER -107.56 131.3 54.5 Favored 'General case' 0 CA--C 1.483 -1.633 0 CA-C-N 118.013 0.907 . . . . 0.0 110.724 177.739 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.34 3.5 p30 -135.0 71.69 68.9 Favored Pre-proline 0 C--N 1.284 -2.28 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 173.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.87 157.19 25.11 Favored 'Trans proline' 0 C--N 1.357 1.016 0 C-N-CA 123.276 2.651 . . . . 0.0 111.472 173.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.5 p -78.17 165.18 24.26 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.425 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.84 -40.83 70.02 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 123.541 0.736 . . . . 0.0 112.04 -179.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.68 -43.75 93.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.188 0.518 . . . . 0.0 110.958 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -64.16 -42.66 96.65 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.544 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 87.7 mt -70.41 -38.59 74.64 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.306 -179.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -64.26 -40.49 96.09 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 123.151 0.58 . . . . 0.0 109.603 177.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.59 -35.56 78.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.76 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.507 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 66.5 mmm -74.38 -33.62 63.1 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.822 177.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.5 mt -66.97 -40.81 86.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 121.371 0.605 . . . . 0.0 109.481 175.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.423 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.9 t30 -63.66 -12.46 34.09 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.254 -178.558 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.507 ' HB2' ' O ' ' A' ' 51' ' ' MET . 12.2 mm-40 -67.21 -23.54 65.75 Favored 'General case' 0 N--CA 1.394 -3.268 0 C-N-CA 123.742 0.817 . . . . 0.0 111.354 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.541 ' CG1' ' HB2' ' A' ' 71' ' ' MET . 17.4 m -119.58 -19.94 5.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.973 174.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.423 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 11.3 t70 -78.46 82.28 4.74 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.771 0.796 . . . . 0.0 111.843 -173.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.92 -21.81 26.06 Favored 'General case' 0 C--N 1.299 -1.621 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.434 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -81.78 -11.97 58.76 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.34 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.77 12.54 84.42 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 115.41 0.924 . . . . 0.0 115.41 173.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -80.48 -14.29 58.39 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.962 1.381 . . . . 0.0 110.395 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 79.75 20.34 68.62 Favored Glycine 0 N--CA 1.437 -1.279 0 CA-C-N 115.843 -0.617 . . . . 0.0 113.432 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.97 148.19 39.95 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.076 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.2 mt -92.26 116.17 32.82 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 108.758 -0.831 . . . . 0.0 108.758 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.44 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 7.1 t70 -87.14 172.53 9.87 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 174.407 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.444 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 46.7 t80 -57.13 -51.65 80.07 Favored Pre-proline 0 CA--C 1.555 1.168 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -175.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.44 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 8.7 Cg_endo -51.58 -42.48 55.81 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 122.973 2.448 . . . . 0.0 112.6 175.387 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.85 -39.63 87.66 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.632 0.729 . . . . 0.0 110.067 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -66.38 -40.66 89.84 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.598 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 78.0 mt -63.73 -37.78 88.66 Favored 'General case' 0 C--O 1.206 -1.196 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.987 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.438 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 86.5 m -59.22 -50.88 72.32 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 123.493 0.496 . . . . 0.0 110.912 178.723 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.541 ' HB2' ' CG1' ' A' ' 55' ' ' VAL . 34.0 ttp -66.03 -36.65 83.82 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.053 0.454 . . . . 0.0 111.84 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.5 mmt -82.22 -24.87 34.64 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.786 -0.766 . . . . 0.0 112.334 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.71 -29.89 67.39 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 173.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.725 ' HA ' ' O ' ' A' ' 78' ' ' ASP . 99.8 mtt180 -66.24 -29.86 70.19 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.731 0.777 . . . . 0.0 109.529 174.034 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -81.94 -12.14 58.53 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.937 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.9 ttm -104.34 -85.99 0.46 Allowed 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.484 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -141.51 15.47 2.18 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -173.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.725 ' O ' ' HA ' ' A' ' 74' ' ' ARG . 23.1 t70 -127.96 162.23 27.27 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.2 m -152.44 157.65 41.49 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 176.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -101.98 -55.01 2.58 Favored 'General case' 0 CA--C 1.499 -0.988 0 CA-C-N 118.772 0.715 . . . . 0.0 110.398 -178.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.8 m -121.22 -165.78 1.27 Allowed 'General case' 0 N--CA 1.412 -2.355 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.3 -178.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.493 ' H ' ' CD ' ' A' ' 82' ' ' GLU . 0.2 OUTLIER -100.34 -1.07 37.07 Favored 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 177.356 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.601 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 44.0 mt-10 -62.84 -58.47 7.29 Favored 'General case' 0 CA--C 1.489 -1.377 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.943 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -49.6 -45.36 47.94 Favored 'General case' 0 C--O 1.251 1.156 0 C-N-CA 124.817 1.247 . . . . 0.0 110.376 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.531 HG21 HG12 ' A' ' 142' ' ' VAL . 40.0 mm -66.75 -50.73 63.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 114.416 -1.265 . . . . 0.0 110.426 -177.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -70.66 -27.68 64.22 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.138 -177.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.601 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 51.4 mt-10 -60.08 -44.9 94.44 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 175.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.34 -38.11 81.17 Favored 'General case' 0 C--O 1.21 -1.008 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.831 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.76 -43.6 83.62 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.404 0.621 . . . . 0.0 110.139 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 -66.23 -26.76 67.52 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 124.739 1.216 . . . . 0.0 111.7 -176.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.0 p -83.76 -19.76 9.39 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 C-N-CA 120.308 -0.557 . . . . 0.0 111.287 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -91.3 -49.78 6.17 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 122.037 -0.414 . . . . 0.0 110.012 177.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -84.42 107.38 16.65 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 177.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -73.28 -26.62 61.16 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.342 -172.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -103.81 -14.18 16.14 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.529 0.68 . . . . 0.0 110.789 -176.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.04 45.15 58.14 Favored Glycine 0 N--CA 1.43 -1.725 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -176.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -85.61 -17.83 35.03 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 121.427 0.632 . . . . 0.0 109.644 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 101.45 16.08 25.7 Favored Glycine 0 N--CA 1.434 -1.449 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.515 173.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -146.71 131.39 17.88 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -177.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.475 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.1 mt -100.68 126.93 54.24 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.598 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.5 t -107.24 144.72 33.63 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.46 94.21 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.208 0.603 . . . . 0.0 111.782 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.56 89.09 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.093 0.473 . . . . 0.0 110.802 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.531 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 5.0 tp10 -72.15 -45.36 60.8 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.498 178.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.506 ' O ' ' HG2' ' A' ' 109' ' ' MET . 8.5 tt -60.23 -37.81 81.49 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 -176.131 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.487 ' HB2' HG21 ' A' ' 121' ' ' VAL . 45.8 ttt180 -63.14 -37.15 86.06 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.727 177.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.531 ' HB2' ' O ' ' A' ' 104' ' ' GLU . 56.7 m170 -51.98 -53.51 40.66 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.365 177.699 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.58 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.3 p -71.02 -30.61 42.01 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.621 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.335 -176.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.506 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.2 mmt -63.6 -47.02 83.16 Favored 'General case' 0 CA--C 1.494 -1.209 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.7 m -62.11 -32.75 73.35 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.406 177.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -73.48 -33.57 64.89 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.216 177.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 84.9 mt -84.65 -20.87 30.62 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.009 0.433 . . . . 0.0 110.986 -176.302 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 89.48 18.12 53.23 Favored Glycine 0 N--CA 1.431 -1.685 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.1 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -84.58 107.57 16.87 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 176.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -70.3 99.63 1.58 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.4 -177.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 62.9 mt -137.1 149.04 47.09 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -89.86 173.83 8.03 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -66.94 -34.17 77.19 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -61.28 -47.41 86.13 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.519 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -62.68 -48.76 77.91 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.459 -177.26 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.487 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.2 m -66.96 -33.42 63.27 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 CA-C-O 121.014 0.435 . . . . 0.0 110.9 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -74.35 -37.12 63.59 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.0 0.429 . . . . 0.0 109.971 178.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.626 ' HG3' ' CE1' ' B' ' 81' ' ' PHE . 8.3 tp10 -61.44 -41.6 97.45 Favored 'General case' 0 C--O 1.248 1.025 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.427 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 62.3 mtt -53.71 -56.83 13.9 Favored 'General case' 0 CA--C 1.504 -0.804 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.752 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.9 mm -57.9 -50.57 77.38 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.724 0 CA-C-N 114.482 -1.236 . . . . 0.0 111.451 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -61.43 -21.67 64.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.501 ' HB2' ' CE1' ' B' ' 81' ' ' PHE . 15.1 tp10 -83.81 -36.91 23.16 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.795 176.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.86 -31.04 40.41 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 120.904 0.383 . . . . 0.0 110.525 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.38 94.65 0.96 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.208 1.403 . . . . 0.0 109.532 175.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.67 -38.89 15.39 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.921 -176.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -74.76 -10.71 59.77 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.777 -176.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.72 45.63 27.38 Favored Glycine 0 N--CA 1.441 -0.984 0 C-N-CA 120.664 -0.779 . . . . 0.0 111.538 178.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -105.37 -15.94 14.89 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.858 0.837 . . . . 0.0 109.664 -176.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.03 5.04 73.98 Favored Glycine 0 CA--C 1.495 -1.176 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -143.71 125.53 15.16 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.475 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.4 OUTLIER -89.21 128.18 41.44 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.274 0 O-C-N 123.556 0.535 . . . . 0.0 110.131 -179.473 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -91.12 170.97 9.58 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.977 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.624 ' O ' HG13 ' A' ' 142' ' ' VAL . 81.6 t80 -54.34 -44.79 72.41 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -175.558 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -68.58 -25.53 64.93 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HB2' HG23 ' A' ' 136' ' ' VAL . 51.7 mt-10 -81.27 -39.1 25.79 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 176.74 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -67.22 -43.03 83.04 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.699 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.624 HG13 ' O ' ' A' ' 138' ' ' TYR . 27.1 m -53.78 -36.52 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.695 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 48.1 tp60 -68.83 -42.21 77.5 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.765 -177.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 27.9 ttt -86.5 -30.24 22.13 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.41 -178.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.412 ' SD ' HG21 ' B' ' 89' ' ' ILE . 14.5 tpt -68.69 -26.56 65.35 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.313 178.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 15.3 t -81.17 -34.8 32.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.191 177.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -113.23 105.43 13.42 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -173.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.413 ' HA ' ' HD2' ' B' ' 82' ' ' LYS . 3.1 mppt? . . . . . 0 C--N 1.31 -1.126 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 14.3 p . . . . . 0 N--CA 1.44 -0.964 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -36.79 99.62 0.03 OUTLIER 'Trans proline' 0 C--N 1.385 2.455 0 C-N-CA 125.073 3.849 . . . . 0.0 115.341 -178.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' B' ' 79' ' ' PHE . . . -156.46 17.42 0.33 Allowed 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.856 177.245 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -102.8 -46.59 4.66 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.16 -175.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 16.1 m -83.22 -40.49 19.56 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.424 ' O ' ' HA ' ' B' ' 76' ' ' ALA . 86.6 m-85 -134.41 145.44 48.91 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 174.343 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.6 m80 -82.68 21.36 1.0 Allowed 'General case' 0 C--N 1.287 -2.131 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -169.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 81' ' ' PHE . . . . . 0.626 ' CE1' ' HG3' ' A' ' 123' ' ' GLU . 54.3 m-85 -39.13 -59.25 1.03 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 116.072 1.879 . . . . 0.0 116.072 -170.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 82' ' ' LYS . . . . . 0.413 ' HD2' ' HA ' ' A' ' 148' ' ' LYS . 30.4 mmtp -76.72 -29.33 56.16 Favored 'General case' 0 C--N 1.315 -0.934 0 C-N-CA 118.768 -1.173 . . . . 0.0 113.186 -173.209 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 83' ' ' GLU . . . . . 0.436 ' O ' ' HB3' ' B' ' 86' ' ' LYS . 37.1 mt-10 -81.63 -27.43 34.14 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.189 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.8 -50.88 54.51 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.556 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.528 ' O ' HG12 ' B' ' 89' ' ' ILE . 84.5 m95 -63.66 -32.19 73.6 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.487 176.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 86' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' B' ' 83' ' ' GLU . 37.8 ttpt -54.09 -58.45 7.27 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 175.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -57.35 -45.54 84.24 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 114.28 -1.327 . . . . 0.0 111.78 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.93 -61.5 2.34 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 124.402 1.064 . . . . 0.0 112.501 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.528 HG12 ' O ' ' B' ' 85' ' ' TRP . 36.7 pt -65.14 -36.26 77.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -174.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 90' ' ' GLN . . . . . 0.467 ' HB3' ' O ' ' B' ' 95' ' ' MET . 26.3 mt-30 -64.33 -55.93 17.91 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.414 ' CG ' ' HB3' ' A' ' 112' ' ' LEU . 3.4 tppp? -68.32 -31.54 71.03 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.645 -174.444 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.88 -37.34 73.03 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.873 178.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -77.89 -1.6 32.58 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-O 121.876 0.846 . . . . 0.0 109.961 177.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 20.7 t60 71.39 29.4 2.74 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.119 1.368 . . . . 0.0 110.076 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.467 ' O ' ' HB3' ' B' ' 90' ' ' GLN . 59.6 ttp -113.56 95.59 37.04 Favored Pre-proline 0 N--CA 1.425 -1.683 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 176.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.48 ' HB3' ' NE2' ' A' ' 41' ' ' GLN . 88.3 Cg_exo -48.21 -74.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.957 2.438 . . . . 0.0 112.361 -177.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 16.6 t70 177.11 99.13 0.12 Allowed Pre-proline 0 CA--C 1.513 -0.465 0 C-N-CA 123.107 0.563 . . . . 0.0 110.037 172.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -103.4 38.14 0.05 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.39 0 C-N-CA 122.895 2.397 . . . . 0.0 109.181 173.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 27.6 t90 -96.63 121.89 38.95 Favored 'General case' 0 CA--C 1.485 -1.526 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.849 -174.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.409 -2.499 0 CA-C-N 114.27 -1.332 . . . . 0.0 108.422 177.976 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 111.253 0.094 . . . . 0.0 111.253 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -138.96 -7.4 1.4 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 173.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -72.36 114.47 10.51 Favored 'General case' 0 CA--C 1.501 -0.935 0 CA-C-O 121.449 0.642 . . . . 0.0 110.339 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.7 tp -132.65 139.58 47.79 Favored 'General case' 0 C--N 1.275 -2.665 0 N-CA-C 103.891 -2.633 . . . . 0.0 103.891 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.2 p -68.18 148.02 51.45 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.602 -0.839 . . . . 0.0 109.254 -177.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -61.94 -25.66 67.73 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.0 0.429 . . . . 0.0 110.591 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -64.94 -51.23 62.99 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.034 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -65.52 -35.17 80.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.788 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.532 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 51.5 mt -67.57 -32.31 56.41 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.269 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.125 177.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.59 -40.53 88.94 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 175.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.45 -43.07 97.22 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.063 175.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -73.61 -15.41 61.27 Favored 'General case' 0 C--O 1.169 -3.179 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 68.6 mttm -72.97 -42.99 62.78 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 119.251 0.932 . . . . 0.0 108.636 175.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -62.36 -50.07 73.03 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.51 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.418 ' HB1' ' HB1' ' B' ' 100' ' ' ALA . . . -63.64 -40.74 97.62 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.137 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.445 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 92.8 t80 -60.17 -48.63 80.93 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 123.289 0.636 . . . . 0.0 110.094 178.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 m -69.3 -17.52 63.74 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 123.426 0.453 . . . . 0.0 111.464 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.88 -34.88 78.75 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 174.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.596 ' CD2' HG21 ' A' ' 35' ' ' VAL . 17.1 m-85 -90.31 -44.98 9.34 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.001 177.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -87.27 83.34 7.39 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -71.55 -15.57 62.29 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -170.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.484 ' OD1' ' HB3' ' A' ' 24' ' ' ASP . 4.3 p-10 -97.37 -9.85 26.65 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 118.885 -1.126 . . . . 0.0 110.007 177.57 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.87 50.58 66.0 Favored Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.403 -0.817 . . . . 0.0 113.373 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.484 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 1.2 p-10 -104.08 -17.3 14.99 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.544 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.54 2.53 50.25 Favored Glycine 0 N--CA 1.436 -1.35 0 C-N-CA 120.022 -1.085 . . . . 0.0 114.513 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 52.9 p -137.31 129.44 29.32 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.606 1.203 . . . . 0.0 109.346 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.1 mt -96.29 122.21 47.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 -174.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -94.84 163.44 13.34 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.039 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 34.1 p -63.55 -30.85 71.91 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.801 0.334 . . . . 0.0 111.5 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -59.93 -46.48 89.25 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.134 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -63.18 -46.87 85.09 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.462 ' HB3' HD22 ' A' ' 48' ' ' LEU . 92.7 mt -54.15 -55.57 26.53 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.21 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.7 -31.56 76.31 Favored Glycine 0 C--N 1.305 -1.165 0 C-N-CA 119.328 -1.415 . . . . 0.0 113.131 -176.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 48.5 m -66.02 -46.73 76.85 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 117.04 0.42 . . . . 0.0 110.569 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.596 HG21 ' CD2' ' A' ' 19' ' ' PHE . 34.1 m -70.02 -37.34 72.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.108 178.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.412 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 1.9 mpp? -64.62 -39.83 94.4 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.528 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.545 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 22.3 ttt180 -66.49 -34.02 76.99 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 121.091 0.472 . . . . 0.0 110.148 178.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.8 m -69.69 -25.68 64.0 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.547 -0.752 . . . . 0.0 109.716 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.6 mt -87.29 -1.62 58.04 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.972 177.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 102.34 -10.0 56.29 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.679 176.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.545 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 60.9 tt0 -95.76 138.85 32.82 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -177.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -117.95 81.68 16.19 Favored Pre-proline 0 C--N 1.301 -1.543 0 O-C-N 121.609 -0.682 . . . . 0.0 109.822 177.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -84.85 149.78 11.05 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 122.293 1.995 . . . . 0.0 111.793 178.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.3 p -90.27 170.28 10.4 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.322 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -55.35 -47.36 75.84 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.447 1.099 . . . . 0.0 110.073 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -45.34 84.13 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.776 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 51' ' ' MET . 42.9 mt-10 -65.61 -44.25 87.09 Favored 'General case' 0 C--O 1.221 -0.431 0 O-C-N 123.655 0.597 . . . . 0.0 111.557 -177.218 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.462 HD22 ' HB3' ' A' ' 32' ' ' LEU . 88.9 mt -69.02 -39.27 79.37 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.277 -177.826 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -71.25 -33.74 70.11 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.89 -36.88 84.8 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.413 0.625 . . . . 0.0 109.394 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.497 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 94.8 mmm -67.51 -47.37 70.19 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.222 177.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 58.5 mt -59.59 -44.12 92.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.18 0.514 . . . . 0.0 110.444 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.503 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.1 t30 -55.55 -28.52 55.36 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 114.908 1.448 . . . . 0.0 114.908 -173.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 51' ' ' MET . 9.5 pt-20 -69.04 -27.24 65.48 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 119.198 -1.001 . . . . 0.0 112.591 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.513 HG11 ' HB2' ' A' ' 71' ' ' MET . 34.7 m -101.67 -11.81 8.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.579 0.705 . . . . 0.0 109.794 177.097 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.503 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 25.9 t70 -87.92 75.7 8.78 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.423 -173.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.6 -20.57 39.52 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.606 0.717 . . . . 0.0 109.798 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -82.38 -6.96 59.61 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.312 178.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 59.54 43.46 97.57 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 115.895 1.118 . . . . 0.0 115.895 172.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -109.64 -1.33 18.17 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 119.252 -0.979 . . . . 0.0 110.721 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 69.34 23.15 76.48 Favored Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.603 -0.726 . . . . 0.0 113.423 176.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -141.29 149.77 41.68 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 52.3 mt -103.87 114.79 44.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.422 ' HB2' ' HD2' ' A' ' 66' ' ' PRO . 1.2 p30 -78.68 163.25 25.6 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 119.724 -0.791 . . . . 0.0 110.261 174.158 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.5 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 31.8 t80 -54.21 -50.5 84.3 Favored Pre-proline 0 C--N 1.313 -1.017 0 O-C-N 123.913 0.758 . . . . 0.0 110.879 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.5 ' HD3' ' HB3' ' A' ' 65' ' ' PHE . 59.5 Cg_exo -47.2 -51.58 9.21 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 122.233 1.955 . . . . 0.0 112.739 171.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.08 -47.13 81.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.324 0.583 . . . . 0.0 110.468 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.445 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 37.4 t80 -61.56 -42.99 99.65 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.31 -177.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 90.9 mt -63.61 -44.14 94.83 Favored 'General case' 0 CA--C 1.504 -0.804 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.542 177.662 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.0 m -59.25 -47.72 84.3 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.778 0.674 . . . . 0.0 109.843 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.513 ' HB2' HG11 ' A' ' 55' ' ' VAL . 36.2 ttp -60.96 -41.33 96.13 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.428 179.159 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 21.3 mmt -69.27 -42.45 75.52 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 178.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.31 -39.63 93.63 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.816 0.341 . . . . 0.0 110.303 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -61.77 -39.59 92.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.927 175.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -80.63 -3.52 50.76 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 122.228 1.013 . . . . 0.0 110.445 -175.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 51.5 ttm -102.63 -1.36 30.36 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-O 121.798 0.809 . . . . 0.0 108.885 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -139.2 22.31 2.58 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 122.104 0.954 . . . . 0.0 109.415 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -103.76 -15.67 15.66 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.994 0.902 . . . . 0.0 111.108 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 28.2 m -84.58 -20.66 31.11 Favored 'General case' 0 C--N 1.263 -3.174 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.17 -170.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -82.06 -12.79 58.07 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 119.877 -0.729 . . . . 0.0 109.781 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.1 m -105.27 1.78 28.39 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 172.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 54.68 29.87 12.38 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.078 1.351 . . . . 0.0 113.607 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.465 ' O ' ' HB2' ' A' ' 87' ' ' GLU . 51.2 mm-40 -52.48 -62.42 1.65 Allowed 'General case' 0 C--O 1.202 -1.409 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -179.54 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -48.16 -45.82 33.92 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.228 1.011 . . . . 0.0 111.464 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.401 ' HA ' ' HG2' ' A' ' 145' ' ' MET . 4.5 mm -69.8 -52.42 31.67 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.012 -171.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.4 ttp180 -75.97 -22.27 56.1 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.278 -177.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 6.4 tp10 -64.6 -52.27 58.4 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 176.05 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.418 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -62.6 -37.91 88.1 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 114.484 -1.235 . . . . 0.0 110.231 179.317 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -65.15 -46.56 80.38 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.457 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -69.73 -27.56 65.06 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.646 0.778 . . . . 0.0 112.752 -175.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.418 HG12 ' O ' ' A' ' 88' ' ' ALA . 13.7 p -72.97 -20.13 18.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 119.464 -0.895 . . . . 0.0 110.438 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -91.5 -60.57 1.85 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 173.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.43 ' CG ' ' H ' ' A' ' 97' ' ' ASN . 14.0 t0 -86.81 82.72 7.73 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 122.689 1.233 . . . . 0.0 109.224 177.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -78.11 -29.64 49.07 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.949 -174.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -85.68 -13.06 49.68 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-O 121.356 0.598 . . . . 0.0 110.329 -174.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.98 63.34 2.31 Favored Glycine 0 N--CA 1.426 -2.013 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 179.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.43 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 38.5 m-80 -92.33 -19.17 22.41 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.55 13.68 79.7 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -166.62 153.49 9.07 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 124.316 1.046 . . . . 0.0 109.587 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.457 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.4 mt -110.94 128.3 67.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 19.1 m -103.53 160.36 14.8 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.09 -45.01 94.13 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 122.256 0.222 . . . . 0.0 111.338 -178.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.44 -43.8 88.91 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 123.75 0.656 . . . . 0.0 110.302 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -57.76 -56.58 20.09 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.094 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.441 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.0 tm? -58.68 -44.65 90.28 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.295 -1.321 . . . . 0.0 108.995 -173.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.514 ' HB2' HG21 ' A' ' 121' ' ' VAL . 27.8 ttp180 -61.0 -48.74 80.41 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.905 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -60.16 -39.48 86.55 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.472 -178.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.572 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 10.0 p -73.32 -34.3 43.29 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.384 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.488 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.593 ' HG3' HD12 ' A' ' 116' ' ' LEU . 23.1 mmt -63.8 -41.87 97.82 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-N 116.741 -0.209 . . . . 0.0 111.415 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.7 m -62.28 -35.73 79.89 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 176.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -68.81 -33.68 74.25 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.435 0.636 . . . . 0.0 110.381 176.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 52.9 mt -82.86 -16.75 46.4 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.331 -176.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.15 34.86 13.38 Favored Glycine 0 N--CA 1.427 -1.932 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.77 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -103.42 140.69 37.13 Favored 'General case' 0 N--CA 1.418 -2.03 0 C-N-CA 119.722 -0.791 . . . . 0.0 109.795 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -81.43 23.9 0.59 Allowed 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 114.51 -1.223 . . . . 0.0 113.035 -173.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.593 HD12 ' HG3' ' A' ' 109' ' ' MET . 13.9 mt -69.01 132.86 47.32 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 120.605 0.241 . . . . 0.0 110.517 -175.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.8 p -80.43 167.25 20.41 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.018 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -64.47 -28.69 69.84 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 176.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -65.18 -55.11 20.47 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.788 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -55.67 -51.4 67.38 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 123.848 0.717 . . . . 0.0 110.884 -177.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.514 HG21 ' HB2' ' A' ' 106' ' ' ARG . 15.2 m -61.22 -37.31 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.354 -177.474 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -72.51 -44.63 61.95 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.35 0.595 . . . . 0.0 109.709 -178.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.503 ' OE1' ' HD3' ' A' ' 126' ' ' ARG . 4.7 tp10 -67.38 -36.19 80.85 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.253 -176.619 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.442 ' HE2' ' HB1' ' B' ' 84' ' ' ALA . 52.3 mtt -56.13 -54.91 39.4 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.014 174.226 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.6 mm -57.74 -48.52 83.34 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.81 0 O-C-N 124.226 0.954 . . . . 0.0 110.42 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.503 ' HD3' ' OE1' ' A' ' 123' ' ' GLU . 57.0 ttt180 -59.42 -37.86 79.14 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 123.743 0.817 . . . . 0.0 112.494 -176.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.496 ' HG3' ' CE2' ' B' ' 81' ' ' PHE . 19.0 mm-40 -81.65 -25.14 35.86 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 178.169 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.88 -28.88 39.89 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 176.393 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.12 85.35 4.31 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 114.362 -1.29 . . . . 0.0 108.725 173.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 53.9 mt -77.46 -23.9 14.52 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.966 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.35 -176.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -86.5 -10.79 53.36 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 120.503 -0.479 . . . . 0.0 112.197 -175.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.2 41.08 22.64 Favored Glycine 0 C--N 1.317 -0.507 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.474 175.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -101.59 -16.14 16.84 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.73 0.776 . . . . 0.0 109.63 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 96.89 -11.19 66.19 Favored Glycine 0 N--CA 1.441 -0.98 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.471 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -136.36 131.28 34.04 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -178.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.457 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.5 p -80.73 113.65 20.47 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-O 120.817 0.341 . . . . 0.0 111.761 -177.518 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -88.46 178.09 6.64 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.506 ' O ' HG13 ' A' ' 142' ' ' VAL . 85.7 t80 -66.76 -39.89 88.04 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -175.54 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.513 ' O ' HG22 ' A' ' 142' ' ' VAL . 22.5 mm-40 -67.2 -28.82 68.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.321 0.582 . . . . 0.0 110.857 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.11 -33.3 44.48 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.414 0.626 . . . . 0.0 110.367 175.54 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -75.33 -29.87 60.12 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.831 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 139' ' ' GLU . 31.7 m -60.0 -33.48 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-O 121.247 0.546 . . . . 0.0 110.612 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -71.79 -40.15 69.4 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.729 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 95.9 mmm -69.31 -39.08 78.46 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.172 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.401 ' HG2' ' HA ' ' A' ' 85' ' ' ILE . 15.5 tpt -67.21 -22.92 65.7 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.62 0.724 . . . . 0.0 110.317 -179.184 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 7.4 m -96.13 9.28 41.41 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 121.795 0.807 . . . . 0.0 109.714 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -100.78 42.23 1.13 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.3 0.571 . . . . 0.0 110.273 -178.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt . . . . . 0 C--N 1.311 -1.082 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.294 -179.476 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 12.1 m . . . . . 0 CA--C 1.543 0.691 0 CA-C-O 120.798 0.332 . . . . 0.0 110.784 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -80.15 -14.17 12.22 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.213 2.609 . . . . 0.0 114.319 -177.19 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -77.94 28.41 0.17 Allowed 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -175.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -146.53 113.39 6.09 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.2 m -106.31 10.81 31.56 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.133 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -77.15 159.69 29.56 Favored 'General case' 0 C--O 1.248 1.019 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -175.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 73.5 t60 -67.52 -21.2 65.49 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 114.486 -1.233 . . . . 0.0 111.808 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 81' ' ' PHE . . . . . 0.496 ' CE2' ' HG3' ' A' ' 127' ' ' GLU . 80.0 m-85 -70.55 -23.84 62.69 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -176.502 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -68.61 -44.29 74.59 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 173.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.16 -47.59 79.27 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.442 ' HB1' ' HE2' ' A' ' 124' ' ' MET . . . -55.75 -58.79 6.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.26 -1.337 . . . . 0.0 111.723 -178.558 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -67.6 -33.0 74.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -56.13 -57.94 10.03 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 175.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -58.44 -40.31 82.23 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.011 -1.45 . . . . 0.0 110.679 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.1 -54.43 44.71 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.803 0.335 . . . . 0.0 111.312 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 80.9 mt -62.78 -38.97 83.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.548 0.69 . . . . 0.0 109.505 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 90' ' ' GLN . . . . . 0.432 ' O ' ' HA ' ' B' ' 94' ' ' HIS . 41.0 tt0 -58.03 -42.91 86.34 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 124.952 1.301 . . . . 0.0 111.548 177.16 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -81.0 -42.73 20.7 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.829 -177.085 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.32 -52.34 9.34 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -175.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 18.0 ttpt -91.41 -11.02 38.94 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -174.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 94' ' ' HIS . . . . . 0.432 ' HA ' ' O ' ' B' ' 90' ' ' GLN . 62.1 m170 70.99 100.27 0.06 Allowed 'General case' 0 CA--C 1.502 -0.897 0 C-N-CA 124.021 0.929 . . . . 0.0 110.035 -172.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.494 ' N ' ' HD3' ' B' ' 96' ' ' PRO . 26.7 ttt -129.21 65.52 74.37 Favored Pre-proline 0 C--N 1.312 -1.057 0 C-N-CA 119.022 -1.071 . . . . 0.0 113.687 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.494 ' HD3' ' N ' ' B' ' 95' ' ' MET . 44.4 Cg_endo -106.36 41.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 124.087 3.191 . . . . 0.0 106.291 164.328 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -65.06 137.54 97.11 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 112.974 -1.921 . . . . 0.0 111.149 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.51 62.4 2.19 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.997 2.465 . . . . 0.0 111.083 176.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 23.9 t90 -76.46 79.63 3.17 Favored 'General case' 0 N--CA 1.426 -1.632 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.983 -178.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 100' ' ' ALA . . . . . 0.545 ' HA ' ' CE1' ' A' ' 19' ' ' PHE . . . . . . . . 0 C--O 1.257 1.449 0 CA-C-N 113.576 -1.647 . . . . 0.0 111.551 -178.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.428 0 N-CA-C 111.284 0.105 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -144.98 -164.9 2.03 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.786 -178.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 81.31 100.73 0.06 Allowed 'General case' 0 C--O 1.24 0.558 0 C-N-CA 125.737 1.615 . . . . 0.0 108.759 -172.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.449 ' HB3' HD11 ' A' ' 9' ' ' ILE . 19.6 tp -108.62 163.48 13.2 Favored 'General case' 0 N--CA 1.42 -1.929 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.436 -172.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.1 p -85.02 145.14 27.85 Favored 'General case' 0 N--CA 1.413 -2.308 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.574 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.441 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.2 mp0 -51.69 -40.24 59.73 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 125.438 1.495 . . . . 0.0 111.969 -176.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.81 -45.36 89.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.889 -178.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -65.88 -45.85 80.57 Favored 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 176.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.553 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 74.8 mt -57.11 -44.26 82.88 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.352 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.856 -178.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.55 93.6 Favored 'General case' 0 C--O 1.256 1.427 0 CA-C-O 121.393 0.616 . . . . 0.0 111.44 177.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.38 -40.59 96.97 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.664 0.745 . . . . 0.0 109.135 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -73.79 -18.78 60.92 Favored 'General case' 0 C--O 1.189 -2.087 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.509 -178.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.553 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.6 mttt -65.69 -50.78 63.67 Favored 'General case' 0 CA--C 1.504 -0.819 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -45.34 88.4 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.941 177.493 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.68 87.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.607 179.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -61.99 -45.57 93.06 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 m -68.58 -18.1 64.26 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.957 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -67.18 -41.9 85.12 Favored 'General case' 0 C--O 1.243 0.739 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 172.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.428 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 79.3 m-85 -81.44 -50.94 8.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.872 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -63.41 101.34 0.31 Allowed 'General case' 0 CA--C 1.502 -0.887 0 O-C-N 124.293 0.996 . . . . 0.0 109.038 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 19' ' ' PHE . 41.7 mmtm -71.94 -9.09 57.87 Favored 'General case' 0 N--CA 1.423 -1.8 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.265 -174.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -107.34 -14.35 14.9 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.55 45.09 90.48 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.516 -0.634 . . . . 0.0 111.516 -176.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -112.74 -15.91 12.88 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 122.621 -0.341 . . . . 0.0 111.59 -175.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.82 16.8 20.75 Favored Glycine 0 N--CA 1.43 -1.708 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.111 179.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 68.0 p -142.37 138.67 31.36 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 117.351 0.575 . . . . 0.0 109.804 173.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 67.8 mt -112.99 114.66 47.61 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 176.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.478 HG22 HG22 ' A' ' 62' ' ' THR . 37.2 p -84.41 174.04 10.41 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.162 -177.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.7 p -61.76 -32.83 73.12 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.613 0.721 . . . . 0.0 109.404 174.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -57.56 -55.05 39.9 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 114.639 -1.164 . . . . 0.0 109.051 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -67.23 -39.39 86.2 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.596 -177.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.2 mt -58.38 -50.6 73.1 Favored 'General case' 0 C--O 1.213 -0.821 0 O-C-N 123.133 0.27 . . . . 0.0 111.482 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.09 -30.76 76.24 Favored Glycine 0 C--O 1.214 -1.112 0 C-N-CA 119.488 -1.339 . . . . 0.0 111.836 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.1 m -64.2 -49.45 71.93 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 120.758 0.314 . . . . 0.0 110.456 176.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.1 m -70.22 -37.54 71.75 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.628 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.688 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtt -65.34 -37.74 87.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.73 -0.214 . . . . 0.0 111.09 178.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -63.92 -33.51 75.87 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.932 0.396 . . . . 0.0 110.078 177.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.8 m -71.01 -30.0 66.11 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.482 177.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -84.64 -19.19 33.3 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 110.29 35.74 2.07 Favored Glycine 0 N--CA 1.442 -0.911 0 C-N-CA 120.978 -0.629 . . . . 0.0 114.475 177.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.6 ' OE1' ' HD3' ' B' ' 96' ' ' PRO . 61.3 tt0 -140.06 132.16 27.98 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 171.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -116.49 83.81 13.97 Favored Pre-proline 0 C--N 1.289 -2.052 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.493 ' HG2' HD21 ' A' ' 48' ' ' LEU . 9.3 Cg_endo -86.96 156.64 8.59 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.583 2.189 . . . . 0.0 112.415 -179.066 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.3 t -82.45 158.29 23.3 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mp0 -59.6 -28.87 67.55 Favored 'General case' 0 C--O 1.21 -1.001 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -43.22 82.86 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.063 0.459 . . . . 0.0 110.696 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -69.21 -44.01 72.95 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.814 0.816 . . . . 0.0 109.456 -178.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.493 HD21 ' HG2' ' A' ' 43' ' ' PRO . 87.8 mt -63.72 -40.49 96.88 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.32 -178.371 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -64.33 -37.85 88.96 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.168 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -59.21 -42.43 90.95 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 123.708 0.63 . . . . 0.0 109.981 179.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.2 tpp -68.36 -52.99 27.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.949 177.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.1 mt -54.76 -49.15 71.06 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.749 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.629 -178.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.421 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 7.8 t30 -58.76 -20.75 52.4 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 123.953 0.901 . . . . 0.0 113.132 -172.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -73.74 -43.02 60.29 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-O 121.214 0.53 . . . . 0.0 110.068 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.678 HG11 ' HB2' ' A' ' 71' ' ' MET . 26.6 m -90.72 -15.41 8.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.896 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.421 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 27.3 t70 -81.57 88.78 6.18 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.681 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.79 -13.16 45.94 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -91.19 -10.33 42.09 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -178.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 74.15 29.02 63.12 Favored Glycine 0 N--CA 1.439 -1.106 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.512 177.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -96.35 -16.48 21.27 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 117.607 0.704 . . . . 0.0 111.784 177.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.69 23.34 64.79 Favored Glycine 0 N--CA 1.441 -1.013 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.7 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.478 HG22 HG22 ' A' ' 28' ' ' THR . 15.2 p -138.42 137.24 37.04 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 54.3 mt -89.61 110.37 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.963 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -175.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -79.89 162.6 24.91 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.494 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 68.3 t80 -52.84 -53.02 59.34 Favored Pre-proline 0 C--N 1.307 -1.252 0 CA-C-O 119.061 -0.495 . . . . 0.0 112.155 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -50.99 -42.23 53.28 Favored 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 122.679 2.253 . . . . 0.0 112.715 174.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -68.48 -35.88 78.17 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.265 0.555 . . . . 0.0 110.287 -179.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -66.29 -39.87 89.67 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 85.8 mt -63.21 -44.12 96.19 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.596 176.268 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 57.4 m -55.14 -50.18 69.91 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 123.676 0.61 . . . . 0.0 109.809 176.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.678 ' HB2' HG11 ' A' ' 55' ' ' VAL . 31.5 ttp -59.46 -45.32 91.95 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.603 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 31.8 tpp -67.62 -39.88 84.7 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.27 0.557 . . . . 0.0 110.842 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.11 -24.81 61.54 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.36 -178.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -75.63 -31.73 59.97 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.775 0.798 . . . . 0.0 108.947 172.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -74.46 -54.25 7.93 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.335 -174.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.459 ' HB3' ' HB2' ' A' ' 80' ' ' ASP . 20.9 ptp -71.25 142.48 50.55 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.257 -176.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 77' ' ' LYS . 9.6 mptt -119.6 79.55 1.45 Allowed 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 105.099 -2.186 . . . . 0.0 105.099 172.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.6 t70 61.94 83.05 0.16 Allowed 'General case' 0 C--N 1.319 -0.76 0 O-C-N 124.855 1.347 . . . . 0.0 108.701 -169.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 33.8 m 74.87 140.57 0.07 Allowed 'General case' 0 CA--C 1.561 1.378 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.655 -176.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.459 ' HB2' ' HB3' ' A' ' 76' ' ' MET . 21.7 t70 -120.72 94.09 4.24 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.272 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.3 m -137.26 -57.01 0.71 Allowed 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.346 178.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -80.95 -21.51 40.34 Favored 'General case' 0 CA--C 1.496 -1.133 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.306 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -50.86 -37.41 43.2 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -62.16 -46.03 90.76 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.488 0.661 . . . . 0.0 111.49 175.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.466 HG21 ' HA ' ' A' ' 142' ' ' VAL . 10.0 mm -70.61 -42.44 77.97 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.556 -176.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -69.34 -34.47 74.67 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.517 -1.22 . . . . 0.0 111.562 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.35 -48.62 79.0 Favored 'General case' 0 CA--C 1.495 -1.171 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.471 ' O ' ' HD2' ' A' ' 92' ' ' PHE . . . -61.0 -44.85 96.81 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 113.238 -1.801 . . . . 0.0 110.701 177.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -63.06 -47.31 83.5 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.086 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -58.17 -35.05 71.0 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 178.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.4 HG12 ' O ' ' A' ' 88' ' ' ALA . 7.9 p -76.59 -28.28 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.278 -178.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.471 ' HD2' ' O ' ' A' ' 88' ' ' ALA . 73.8 m-85 -86.63 -42.29 13.56 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.885 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -73.59 85.56 1.59 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.941 0.877 . . . . 0.0 109.411 177.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -79.44 -42.7 24.81 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.952 -175.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.22 -13.03 51.2 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.859 -175.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.05 54.57 4.07 Favored Glycine 0 C--N 1.307 -1.075 0 C-N-CA 120.149 -1.024 . . . . 0.0 110.558 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -100.22 -19.96 16.15 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.06 2.03 88.36 Favored Glycine 0 C--O 1.24 0.499 0 N-CA-C 110.24 -1.144 . . . . 0.0 110.24 -177.123 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.515 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 42.4 m-85 -142.22 130.75 22.53 Favored 'General case' 0 N--CA 1.425 -1.686 0 C-N-CA 126.262 1.825 . . . . 0.0 106.38 -178.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.436 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.0 mt -81.19 126.98 39.91 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.6 t -94.33 150.54 20.18 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.68 -44.88 80.61 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.631 0.253 . . . . 0.0 111.136 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.27 -34.87 78.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.414 0.626 . . . . 0.0 109.643 178.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -67.17 -45.97 75.39 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.057 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.9 tt -63.6 -40.0 95.82 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 179.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? -61.66 -39.84 92.8 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.298 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -58.32 -49.75 76.08 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.629 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.488 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.9 p -68.06 -30.16 47.13 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.667 0 C-N-CA 120.327 -0.549 . . . . 0.0 109.795 -179.102 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.8 mmt -63.96 -42.25 97.34 Favored 'General case' 0 CA--C 1.491 -1.299 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.7 m -66.4 -32.44 73.82 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -73.56 -29.01 62.16 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.652 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 79.5 mt -91.2 -9.8 44.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.388 0.613 . . . . 0.0 110.165 -178.049 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 75.9 20.37 77.92 Favored Glycine 0 N--CA 1.435 -1.405 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.363 179.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -76.56 -27.53 55.93 Favored 'General case' 0 CA--C 1.495 -1.156 0 CA-C-N 116.98 0.39 . . . . 0.0 110.951 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 59.96 42.64 15.79 Favored 'General case' 0 C--O 1.236 0.362 0 O-C-N 124.32 1.013 . . . . 0.0 111.689 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 58.5 mt -86.27 154.8 21.0 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.476 ' H ' ' CD ' ' A' ' 120' ' ' GLU . 20.7 p -101.78 177.31 4.94 Favored 'General case' 0 N--CA 1.426 -1.626 0 C-N-CA 119.061 -1.056 . . . . 0.0 110.743 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.433 ' HA ' HG22 ' A' ' 121' ' ' VAL . 6.3 p-10 -65.21 -18.55 65.4 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.145 0.498 . . . . 0.0 110.853 -177.685 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -70.69 -57.05 5.09 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.472 -177.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.476 ' CD ' ' H ' ' A' ' 117' ' ' THR . 3.5 pm0 -70.08 -35.52 74.25 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.336 -177.723 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.486 ' O ' HG12 ' A' ' 125' ' ' ILE . 5.9 m -70.93 -26.56 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.42 -178.36 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -72.82 -35.64 67.34 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -67.48 -36.0 80.27 Favored 'General case' 0 C--N 1.352 0.704 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 176.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.42 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 65.2 mtt -55.15 -46.56 75.71 Favored 'General case' 0 CA--C 1.509 -0.608 0 O-C-N 124.145 0.903 . . . . 0.0 109.933 176.271 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.486 HG12 ' O ' ' A' ' 121' ' ' VAL . 51.2 mm -66.32 -53.99 30.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.258 177.346 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -45.82 -59.66 2.67 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 126.274 1.83 . . . . 0.0 114.555 -174.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.67 ' HB2' ' CE1' ' B' ' 81' ' ' PHE . 12.2 mm-40 -69.44 -20.08 63.77 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.921 0.391 . . . . 0.0 111.64 -176.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -92.31 -21.26 20.38 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.636 0.732 . . . . 0.0 110.154 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -79.6 73.26 6.3 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 122.323 1.059 . . . . 0.0 110.282 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.424 ' HB ' ' HG3' ' A' ' 140' ' ' GLU . 27.9 mt -82.98 -9.71 11.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 CA-C-N 114.605 -1.18 . . . . 0.0 108.757 176.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -84.8 -11.84 54.9 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.46 0.648 . . . . 0.0 109.537 -178.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 65.7 36.26 92.11 Favored Glycine 0 N--CA 1.436 -1.313 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.453 177.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -101.29 -16.38 16.96 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.329 0.585 . . . . 0.0 110.289 -176.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.15 0.25 68.19 Favored Glycine 0 C--N 1.312 -0.796 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -176.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.515 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 96.0 mt-30 -144.36 138.91 28.15 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.436 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.3 p -83.45 118.98 31.93 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -176.255 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.423 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 37.7 t30 -73.8 156.3 37.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.788 1.235 . . . . 0.0 110.489 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.467 ' O ' HG13 ' A' ' 142' ' ' VAL . 80.2 t80 -56.81 -48.79 77.18 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 122.738 0.415 . . . . 0.0 111.725 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.441 ' O ' HG22 ' A' ' 142' ' ' VAL . 27.0 mm-40 -65.98 -33.93 76.94 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.994 0.426 . . . . 0.0 111.971 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.424 ' HG3' ' HB ' ' A' ' 130' ' ' ILE . 1.3 mp0 -71.67 -34.5 69.76 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 121.219 0.533 . . . . 0.0 110.157 175.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -68.34 -42.46 79.24 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.81 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.467 HG13 ' O ' ' A' ' 138' ' ' TYR . 8.9 m -63.58 -36.61 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 120.283 -0.567 . . . . 0.0 109.646 178.424 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -64.7 -49.5 70.64 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.712 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -69.41 -44.61 71.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.515 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.7 tpt -65.66 -38.04 88.22 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 111.455 0.169 . . . . 0.0 111.455 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 74.5 m -81.15 -8.69 59.81 Favored 'General case' 0 CA--C 1.559 1.312 0 CA-C-O 121.258 0.552 . . . . 0.0 110.469 177.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.57 102.99 8.22 Favored 'General case' 0 C--O 1.249 1.076 0 O-C-N 121.811 -0.555 . . . . 0.0 110.042 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm . . . . . 0 C--O 1.254 1.297 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.138 178.898 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.448 -0.53 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -80.28 10.99 3.0 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.236 2.624 . . . . 0.0 112.71 -178.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.441 ' HB3' ' HB2' ' B' ' 81' ' ' PHE . . . -50.17 115.22 1.33 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.619 1.168 . . . . 0.0 113.047 -177.001 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 55.65 -87.23 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.255 1.822 . . . . 0.0 113.9 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 44.7 m -99.21 23.4 9.21 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.241 0.543 . . . . 0.0 109.596 -179.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 66.58 23.09 10.43 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.811 1.244 . . . . 0.0 110.37 177.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 80' ' ' HIS . . . . . 0.413 ' HB3' ' HB2' ' B' ' 83' ' ' GLU . 42.9 m80 -140.72 92.13 2.48 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.778 -178.102 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 81' ' ' PHE . . . . . 0.67 ' CE1' ' HB2' ' A' ' 127' ' ' GLU . 89.3 t80 -86.52 -39.27 16.4 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -64.16 -50.41 68.27 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.896 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 83' ' ' GLU . . . . . 0.413 ' HB2' ' HB3' ' B' ' 80' ' ' HIS . 24.4 mp0 -61.96 -35.72 79.31 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 123.099 0.559 . . . . 0.0 110.273 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.406 ' HB1' ' HE2' ' A' ' 124' ' ' MET . . . -60.25 -55.83 28.95 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.474 179.341 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.565 ' O ' HG12 ' B' ' 89' ' ' ILE . 35.9 m95 -67.43 -37.56 83.21 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 177.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -54.37 -56.78 15.17 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -63.14 -27.83 69.64 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.259 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.36 -55.16 8.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.618 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.565 HG12 ' O ' ' B' ' 85' ' ' TRP . 44.7 mm -57.38 -50.53 76.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.831 0.824 . . . . 0.0 109.188 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 90' ' ' GLN . . . . . 0.562 ' NE2' ' HB2' ' A' ' 41' ' ' GLN . 29.9 tt0 -61.51 -43.29 99.13 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 113.949 -1.478 . . . . 0.0 112.278 -176.268 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -76.15 -31.46 58.58 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.325 -0.55 . . . . 0.0 111.337 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.09 -38.08 89.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.545 0.688 . . . . 0.0 109.621 177.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 38.0 mttm -74.86 -32.12 61.8 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.599 175.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 27.9 t60 90.67 -27.64 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 127.686 2.394 . . . . 0.0 109.778 -176.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 25.7 mmt -137.98 151.1 69.47 Favored Pre-proline 0 C--N 1.303 -1.451 0 N-CA-C 105.839 -1.912 . . . . 0.0 105.839 177.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.6 ' HD3' ' OE1' ' A' ' 41' ' ' GLN . 12.5 Cg_exo -70.19 -17.98 35.26 Favored 'Trans proline' 0 C--O 1.223 -0.236 0 C-N-CA 121.186 1.258 . . . . 0.0 109.93 176.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 97' ' ' ASP . . . . . 0.402 ' HA ' ' HD3' ' B' ' 98' ' ' PRO . 29.0 m-20 82.18 137.34 0.05 OUTLIER Pre-proline 0 CA--C 1.51 -0.591 0 C-N-CA 126.605 1.962 . . . . 0.0 111.124 -175.568 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 98' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' B' ' 97' ' ' ASP . 4.7 Cg_exo -76.7 101.59 1.52 Allowed 'Trans proline' 0 N--CA 1.443 -1.486 0 C-N-CA 121.439 1.426 . . . . 0.0 109.786 176.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -82.59 161.14 22.36 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.612 0.72 . . . . 0.0 111.007 -178.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.414 -2.267 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 172.914 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.69 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -145.25 -9.76 0.57 Allowed 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -110.65 153.92 24.55 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.442 ' HB3' HD11 ' A' ' 9' ' ' ILE . 20.1 tp -132.57 158.17 42.85 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -176.537 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.1 p -77.31 151.03 35.19 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.585 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -59.09 -36.1 74.55 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -176.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -58.85 -52.83 64.06 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 121.261 0.553 . . . . 0.0 109.72 177.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -62.58 -46.69 87.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.032 -177.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.515 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 75.2 mt -60.0 -36.71 68.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 O-C-N 123.588 0.555 . . . . 0.0 111.084 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.19 -44.93 86.83 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-O 120.647 0.26 . . . . 0.0 110.527 177.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -61.57 -36.63 81.19 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.717 176.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.475 ' CZ ' ' HG2' ' A' ' 72' ' ' MET . 56.0 m-85 -72.32 -33.94 67.71 Favored 'General case' 0 C--O 1.185 -2.323 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 177.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 99.2 mttt -59.03 -42.99 91.54 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.756 0.788 . . . . 0.0 109.794 176.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.34 -54.46 40.17 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.592 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.9 -31.44 69.23 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.042 -176.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -63.11 -48.25 79.33 Favored 'General case' 0 C--O 1.206 -1.237 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 177.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -68.84 -17.33 63.98 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.251 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.6 tp -72.0 -31.8 66.58 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.414 0.626 . . . . 0.0 110.04 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.49 ' CD2' HG21 ' A' ' 35' ' ' VAL . 10.5 m-85 -95.75 -35.86 11.39 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.114 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -77.64 99.38 5.77 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 175.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.69 -21.89 66.85 Favored 'General case' 0 C--N 1.307 -1.251 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -173.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.438 ' OD2' ' HB3' ' A' ' 24' ' ' ASP . 7.5 p-10 -113.12 -13.32 13.04 Favored 'General case' 0 C--N 1.305 -1.353 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.517 179.014 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.33 57.01 7.89 Favored Glycine 0 C--O 1.242 0.62 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.686 176.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.438 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 2.9 p-10 -112.91 -13.93 13.09 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 120.956 0.407 . . . . 0.0 110.518 -177.258 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.28 6.95 44.17 Favored Glycine 0 N--CA 1.433 -1.545 0 C-N-CA 121.172 -0.537 . . . . 0.0 112.79 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.447 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 74.6 p -137.78 131.27 30.97 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 117.288 0.544 . . . . 0.0 109.68 175.005 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.3 mt -102.26 124.99 56.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.993 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 177.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 27.0 p -94.3 167.7 11.37 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.294 178.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 40.0 p -64.82 -26.36 68.31 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 120.901 0.381 . . . . 0.0 110.238 177.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -55.32 -60.65 3.11 Favored 'General case' 0 C--O 1.242 0.668 0 C-N-CA 124.16 0.984 . . . . 0.0 108.941 174.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.88 -42.95 98.94 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 113.986 -1.461 . . . . 0.0 109.873 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -56.43 -61.73 2.21 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.878 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.17 -31.84 82.11 Favored Glycine 0 C--N 1.309 -0.969 0 C-N-CA 119.303 -1.427 . . . . 0.0 113.43 -174.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.6 m -67.59 -44.46 78.06 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 116.864 0.332 . . . . 0.0 111.068 178.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.514 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 31.3 m -71.48 -35.98 58.84 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 C-N-CA 119.699 -0.801 . . . . 0.0 110.152 178.316 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -64.11 -44.4 92.38 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.866 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -64.69 -33.42 75.9 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.86 0.362 . . . . 0.0 110.198 178.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 m -70.77 -21.46 62.5 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.091 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 92.2 mt -88.98 -22.77 22.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.71 0.291 . . . . 0.0 110.45 177.613 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.89 3.44 31.93 Favored Glycine 0 C--N 1.314 -0.693 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.728 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -101.47 131.47 47.58 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -121.47 79.87 37.84 Favored Pre-proline 0 C--N 1.298 -1.658 0 C-N-CA 119.709 -0.796 . . . . 0.0 112.704 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -78.81 153.97 26.2 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 121.703 1.602 . . . . 0.0 108.675 169.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.433 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 47.6 p -81.85 173.33 12.36 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.134 -178.02 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -59.12 -40.76 86.42 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 123.827 0.851 . . . . 0.0 110.658 -176.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.43 -35.87 68.43 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.248 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.433 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 23.0 mm-40 -60.51 -47.97 83.8 Favored 'General case' 0 C--O 1.241 0.607 0 O-C-N 123.502 0.501 . . . . 0.0 110.943 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.444 ' O ' HG13 ' A' ' 52' ' ' ILE . 78.9 mt -62.43 -41.06 98.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.129 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -67.52 -36.57 81.29 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.548 -177.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -67.57 -42.03 83.23 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.013 0.435 . . . . 0.0 109.983 178.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.758 ' SD ' ' HA ' ' B' ' 96' ' ' PRO . 46.5 tpp -60.06 -36.8 78.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.97 -1.013 . . . . 0.0 109.653 178.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 48' ' ' LEU . 49.0 mt -65.84 -50.21 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.143 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.4 175.171 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.504 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.0 t30 -60.98 -23.39 65.32 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -174.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.68 -44.4 73.32 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 123.98 0.912 . . . . 0.0 109.238 175.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.8 m -105.6 -15.49 8.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -177.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.504 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 27.7 t0 -72.17 103.8 3.44 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.062 0.458 . . . . 0.0 111.581 -176.283 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.07 -21.61 25.95 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.325 -179.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.05 -12.08 57.48 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.277 -174.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 62.8 29.84 75.22 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -173.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -100.12 -8.98 23.05 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.199 0.523 . . . . 0.0 110.853 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 86.82 12.83 68.07 Favored Glycine 0 N--CA 1.432 -1.602 0 CA-C-N 115.856 -0.611 . . . . 0.0 114.018 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.447 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 53.9 p -132.35 150.86 52.07 Favored 'General case' 0 C--O 1.255 1.363 0 CA-C-N 117.919 0.859 . . . . 0.0 111.124 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.405 HG13 HG12 ' A' ' 52' ' ' ILE . 86.1 mt -91.76 112.35 25.45 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.719 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.203 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -80.28 153.11 28.68 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 175.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.421 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 31.2 t80 -53.03 -50.15 83.51 Favored Pre-proline 0 CA--C 1.553 1.096 0 O-C-N 123.429 0.456 . . . . 0.0 111.93 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.1 Cg_endo -49.72 -47.55 22.62 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.653 2.235 . . . . 0.0 112.872 173.507 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -62.74 -41.42 99.17 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 121.786 0.803 . . . . 0.0 110.425 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.555 ' CZ ' ' HB3' ' B' ' 100' ' ' ALA . 4.9 t80 -61.43 -43.97 97.95 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.382 176.623 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.6 mt -62.91 -35.11 78.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.937 178.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.9 m -58.68 -53.54 57.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 122.617 0.367 . . . . 0.0 111.191 178.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -64.97 -31.55 72.84 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.856 -177.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.475 ' HG2' ' CZ ' ' A' ' 12' ' ' PHE . 13.1 tpp -79.21 -38.75 34.95 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 119.66 -0.816 . . . . 0.0 110.978 -176.358 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.75 -24.31 62.59 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-O 120.682 0.277 . . . . 0.0 110.942 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -72.34 -27.34 62.35 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 121.244 0.545 . . . . 0.0 110.289 174.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.599 ' HD2' ' SD ' ' B' ' 95' ' ' MET . 47.6 tttp -78.68 -47.76 16.34 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 176.629 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 65.6 mtp -83.12 62.74 6.78 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 113.976 -1.465 . . . . 0.0 110.927 -177.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -125.34 -169.72 2.04 Favored 'General case' 0 N--CA 1.41 -2.439 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 177.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -81.73 97.09 7.77 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 175.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.4 m -87.96 86.01 7.07 Favored 'General case' 0 N--CA 1.419 -1.994 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 176.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -90.89 3.07 55.55 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 114.715 -1.129 . . . . 0.0 110.581 -175.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 58.9 p -102.48 -176.91 3.24 Favored 'General case' 0 N--CA 1.402 -2.836 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.17 3.87 46.62 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.54 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 47.5 mt-10 -53.59 -63.4 1.16 Allowed 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -170.05 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -83.95 -21.65 31.73 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 121.739 0.78 . . . . 0.0 109.589 -176.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.4 mm -66.75 -47.33 83.26 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.407 -172.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -73.28 -30.5 63.45 Favored 'General case' 0 N--CA 1.423 -1.82 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.45 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 39.4 mt-10 -64.63 -46.22 83.48 Favored 'General case' 0 C--O 1.247 0.938 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.115 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.455 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -67.68 -42.51 81.99 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.274 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -60.06 -45.63 92.24 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 178.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -60.85 -31.08 70.53 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.649 0.78 . . . . 0.0 112.465 -179.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 88' ' ' ALA . 14.5 p -79.52 -27.27 12.78 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 C-N-CA 119.173 -1.011 . . . . 0.0 111.63 -179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -82.14 -52.53 6.9 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -87.84 81.47 7.56 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 122.558 1.17 . . . . 0.0 108.159 175.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -76.09 -29.71 58.04 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 113.24 -1.8 . . . . 0.0 110.575 -174.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -73.97 -13.79 60.93 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.198 0.523 . . . . 0.0 110.72 178.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 66.24 42.83 93.98 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.981 -0.554 . . . . 0.0 113.491 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -98.56 -10.7 23.05 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 122.576 -0.367 . . . . 0.0 111.91 -179.33 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 102.19 4.45 50.55 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.357 -0.925 . . . . 0.0 113.24 174.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -151.99 132.42 13.78 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-O 121.168 0.509 . . . . 0.0 111.266 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.469 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.1 mt -79.11 128.59 38.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 -177.514 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.6 t -113.61 145.32 41.45 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 176.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.49 -50.45 62.71 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -173.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.36 -44.08 84.06 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 123.278 0.361 . . . . 0.0 111.86 -177.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -71.89 -37.74 70.08 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.992 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.491 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.1 tt -60.59 -43.5 97.3 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 178.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -64.41 -45.53 87.21 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 23.2 t-80 -59.2 -46.95 87.08 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.391 -178.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.546 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.2 p -66.38 -36.69 77.95 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.131 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.724 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.491 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.5 mmt -59.88 -42.27 93.4 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-O 120.699 0.285 . . . . 0.0 111.552 178.594 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 16.4 m -62.07 -35.42 78.6 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.633 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -74.39 -32.38 62.69 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.371 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.66 HD13 ' HA ' ' B' ' 92' ' ' ALA . 60.9 mt -84.9 -20.14 31.21 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.722 -174.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.68 35.61 6.8 Favored Glycine 0 N--CA 1.423 -2.179 0 C-N-CA 119.773 -1.204 . . . . 0.0 111.792 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.546 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 11.0 tp10 -120.19 111.98 18.51 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 176.455 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -80.28 94.36 6.08 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.767 -178.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.465 HD21 ' HG3' ' A' ' 114' ' ' GLU . 15.0 mt -119.89 132.3 55.51 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 105.735 -1.95 . . . . 0.0 105.735 176.033 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.4 p -94.27 -176.86 4.09 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 118.552 -1.259 . . . . 0.0 109.783 178.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -56.46 -42.07 77.57 Favored 'General case' 0 C--O 1.208 -1.098 0 C-N-CA 123.374 0.67 . . . . 0.0 111.585 -175.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -69.62 -24.7 63.69 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 113.399 0.888 . . . . 0.0 113.399 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -79.43 -46.91 16.63 Favored 'General case' 0 CA--C 1.499 -0.998 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.585 175.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.49 ' O ' HG12 ' A' ' 125' ' ' ILE . 13.9 m -65.67 -34.85 73.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.92 -43.13 99.64 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 123.516 0.726 . . . . 0.0 110.453 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -65.98 -40.93 91.65 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.401 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 64.2 mtt -60.87 -41.05 95.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.235 178.257 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.49 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.0 mm -65.26 -53.03 45.14 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.804 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -56.32 -40.7 74.82 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.359 0.664 . . . . 0.0 112.426 -175.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -79.57 -8.17 58.99 Favored 'General case' 0 C--N 1.309 -1.189 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.505 ' HB1' HG21 ' A' ' 136' ' ' VAL . . . -108.76 -22.58 12.16 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-O 121.3 0.572 . . . . 0.0 110.294 177.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -71.64 95.92 1.51 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 125.087 1.355 . . . . 0.0 109.479 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 63.3 mt -83.74 -48.69 17.05 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.167 -177.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -86.13 -11.3 53.0 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -172.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 84.7 66.87 1.44 Allowed Glycine 0 C--N 1.296 -1.647 0 C-N-CA 120.233 -0.984 . . . . 0.0 112.837 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -112.19 -16.35 13.02 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 177.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.06 5.41 67.92 Favored Glycine 0 CA--C 1.506 -0.516 0 N-CA-C 109.191 -1.563 . . . . 0.0 109.191 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -151.22 151.25 31.61 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.883 1.673 . . . . 0.0 106.868 -176.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.505 HG21 ' HB1' ' A' ' 128' ' ' ALA . 0.8 OUTLIER -104.28 116.2 47.63 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.971 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -176.689 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -78.49 161.09 27.32 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.528 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.432 ' O ' HG13 ' A' ' 142' ' ' VAL . 81.8 t80 -55.58 -45.24 77.41 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 123.165 0.586 . . . . 0.0 112.045 -177.505 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.418 ' O ' HG22 ' A' ' 142' ' ' VAL . 38.2 mm-40 -66.91 -21.47 65.99 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.117 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -84.32 -38.09 20.81 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 175.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -74.5 -25.03 59.1 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.681 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.432 HG13 ' O ' ' A' ' 138' ' ' TYR . 35.1 m -56.42 -27.94 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-O 121.116 0.484 . . . . 0.0 110.623 176.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -78.11 -64.3 1.19 Allowed 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 176.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.526 ' HA ' ' O ' ' A' ' 147' ' ' ALA . 16.2 tpt -57.36 -28.72 63.41 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -171.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -57.13 -51.81 67.82 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.324 0.583 . . . . 0.0 110.028 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 19.8 m -99.82 -38.73 8.53 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.657 -177.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.526 ' O ' ' HA ' ' A' ' 144' ' ' MET . . . -94.44 104.42 16.38 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 43.9 mttp . . . . . 0 C--N 1.296 -1.732 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.044 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 40.7 m . . . . . 0 CA--C 1.556 1.181 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -100.58 13.81 0.46 Allowed 'Trans proline' 0 C--N 1.375 1.965 0 CA-C-N 121.338 1.513 . . . . 0.0 112.86 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' B' ' 81' ' ' PHE . . . -97.66 -33.21 11.4 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.003 -176.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 77' ' ' ASN . . . . . 0.484 ' HA ' ' CG ' ' B' ' 81' ' ' PHE . 30.8 p-10 -75.95 -11.07 59.89 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.381 0.61 . . . . 0.0 110.685 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 12.6 m -70.13 -44.0 69.81 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.874 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -143.96 141.53 30.24 Favored 'General case' 0 CA--C 1.515 -0.389 0 O-C-N 122.056 -0.403 . . . . 0.0 110.566 -176.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 46.5 t60 71.2 3.75 4.78 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.359 1.064 . . . . 0.0 112.205 173.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 81' ' ' PHE . . . . . 0.484 ' CG ' ' HA ' ' B' ' 77' ' ' ASN . 67.8 t80 -75.6 -30.5 59.6 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.6 0.714 . . . . 0.0 109.995 -177.385 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -60.47 -49.17 78.61 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.66 -1.155 . . . . 0.0 109.23 175.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -71.34 -27.26 63.25 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.601 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.53 -53.45 54.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.965 179.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.401 ' CZ2' ' HB3' ' A' ' 124' ' ' MET . 32.2 m95 -67.36 -35.61 79.71 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 177.501 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -52.41 -55.37 22.23 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.181 0.925 . . . . 0.0 108.636 177.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -68.17 -38.56 82.21 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-N 114.129 -1.396 . . . . 0.0 112.581 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.35 -50.41 71.58 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -176.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 27.3 pt -72.9 -19.72 18.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.516 0.674 . . . . 0.0 112.456 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -79.16 -49.67 12.21 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-O 121.981 0.896 . . . . 0.0 109.535 175.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.546 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 18.5 tptm -71.39 -53.97 12.28 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 125.939 1.696 . . . . 0.0 113.596 -175.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.66 ' HA ' HD13 ' A' ' 112' ' ' LEU . . . -54.27 -51.92 63.02 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -169.102 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -78.91 3.1 17.98 Favored 'General case' 0 N--CA 1.417 -2.105 0 O-C-N 122.13 -0.356 . . . . 0.0 111.378 -177.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 54.44 65.02 1.62 Allowed 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 124.526 1.13 . . . . 0.0 108.566 -175.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 95' ' ' MET . . . . . 0.599 ' SD ' ' HD2' ' A' ' 75' ' ' LYS . 13.1 ttt -74.46 -66.19 0.49 Allowed Pre-proline 0 N--CA 1.438 -1.053 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.028 -179.443 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.758 ' HA ' ' SD ' ' A' ' 51' ' ' MET . 31.2 Cg_endo -104.39 -166.4 0.04 OUTLIER 'Trans proline' 0 N--CA 1.416 -3.084 0 N-CA-C 108.493 -1.387 . . . . 0.0 108.493 169.124 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 97' ' ' ASP . . . . . 0.613 ' H ' ' HD2' ' B' ' 98' ' ' PRO . 11.4 m-20 -106.81 -47.34 0.11 Allowed Pre-proline 0 C--N 1.282 -2.369 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.26 169.543 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 98' ' ' PRO . . . . . 0.613 ' HD2' ' H ' ' B' ' 97' ' ' ASP . 36.6 Cg_endo -69.29 95.22 0.51 Allowed 'Trans proline' 0 C--N 1.377 2.034 0 CA-C-N 120.825 1.33 . . . . 0.0 110.262 172.212 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 99' ' ' TRP . . . . . 0.456 ' CD2' ' HD3' ' B' ' 91' ' ' LYS . 5.7 m-90 -81.39 78.58 8.15 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.158 0.98 . . . . 0.0 111.37 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 100' ' ' ALA . . . . . 0.555 ' HB3' ' CZ ' ' A' ' 68' ' ' PHE . . . . . . . . 0 N--CA 1.4 -2.939 0 CA-C-N 114.028 -1.442 . . . . 0.0 107.562 -177.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.8 mm? . . . . . 0 N--CA 1.395 -3.203 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.461 ' O ' HG13 ' A' ' 9' ' ' ILE . 27.0 p -88.1 170.09 11.37 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 174.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -64.93 -43.82 91.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -174.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -64.89 -36.56 84.74 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.838 0.827 . . . . 0.0 108.987 178.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.431 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 6.0 tp-100 -62.39 -50.27 72.21 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.349 -1.296 . . . . 0.0 108.983 178.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 5' ' ' THR . 82.5 mt -59.14 -39.7 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.571 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.5 -34.66 77.3 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.151 0.501 . . . . 0.0 111.466 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -74.42 -36.59 63.44 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.431 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 23.7 m-85 -69.19 -31.59 70.31 Favored 'General case' 0 C--O 1.2 -1.509 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.861 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -55.43 -48.18 74.83 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 172.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.81 -58.86 6.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.37 178.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.34 -48.34 62.45 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.381 0.672 . . . . 0.0 111.117 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.428 ' HZ ' ' O ' ' A' ' 25' ' ' GLY . 64.2 t80 -56.1 -44.88 79.48 Favored 'General case' 0 C--O 1.213 -0.816 0 C-N-CA 124.312 1.045 . . . . 0.0 110.892 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.4 m -73.47 -27.44 61.4 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.723 -177.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.62 -34.07 77.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.009 0.433 . . . . 0.0 111.564 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -87.74 -36.59 17.26 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.901 176.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -76.85 87.98 3.44 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-O 122.12 0.962 . . . . 0.0 109.931 176.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.499 ' HE3' ' CG2' ' A' ' 34' ' ' THR . 61.5 mttm -68.66 -28.36 66.81 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.574 -1.193 . . . . 0.0 112.655 -175.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.539 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 23.9 m-20 -82.84 -14.12 54.92 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.541 -0.864 . . . . 0.0 110.539 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.85 44.42 97.09 Favored Glycine 0 CA--C 1.517 0.205 0 O-C-N 123.353 0.408 . . . . 0.0 112.082 -178.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.539 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 4.6 p30 -113.18 -16.45 12.57 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 120.797 0.332 . . . . 0.0 111.018 -176.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.428 ' O ' ' HZ ' ' A' ' 16' ' ' PHE . . . 102.32 4.42 50.17 Favored Glycine 0 N--CA 1.431 -1.646 0 C-N-CA 120.014 -1.088 . . . . 0.0 114.666 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.9 p -138.63 130.77 28.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 118.33 1.065 . . . . 0.0 110.769 172.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 56.6 mt -93.1 128.68 44.43 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 C-N-CA 122.371 0.269 . . . . 0.0 110.368 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 p -101.47 171.51 7.53 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 123.635 0.774 . . . . 0.0 110.149 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 47.1 p -69.19 -24.84 64.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.273 0.559 . . . . 0.0 109.907 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -57.63 -53.08 62.2 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.236 175.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -67.66 -42.8 81.59 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 114.124 -1.398 . . . . 0.0 110.723 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.1 mt -59.67 -54.19 49.25 Favored 'General case' 0 C--O 1.204 -1.303 0 O-C-N 123.767 0.667 . . . . 0.0 110.314 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.91 -27.99 69.54 Favored Glycine 0 C--N 1.313 -0.741 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.035 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.499 ' CG2' ' HE3' ' A' ' 21' ' ' LYS . 58.0 m -75.6 -43.15 49.61 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 116.941 0.371 . . . . 0.0 110.804 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.416 HG13 ' HE2' ' A' ' 21' ' ' LYS . 31.5 m -68.5 -33.98 63.0 Favored 'Isoleucine or valine' 0 C--N 1.344 0.34 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.487 178.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -65.5 -40.63 93.25 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.262 173.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -59.8 -48.07 83.15 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 123.137 0.575 . . . . 0.0 110.072 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.3 m -69.51 -21.1 63.7 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.305 0.574 . . . . 0.0 111.041 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.558 HD11 ' O ' ' A' ' 112' ' ' LEU . 3.4 tm? -83.05 -23.2 33.27 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.73 39.71 3.09 Favored Glycine 0 N--CA 1.433 -1.521 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.512 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.473 ' C ' HD22 ' A' ' 42' ' ' ASN . 35.6 tt0 -143.96 135.58 26.05 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 177.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.473 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.76 84.36 43.56 Favored Pre-proline 0 C--N 1.301 -1.515 0 O-C-N 122.167 -0.333 . . . . 0.0 110.193 176.255 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -76.83 170.87 19.02 Favored 'Trans proline' 0 C--O 1.242 0.721 0 C-N-CA 122.475 2.117 . . . . 0.0 110.163 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.524 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 77.0 p -89.42 164.38 14.88 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.904 -177.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -57.17 -41.66 79.67 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 124.356 1.062 . . . . 0.0 108.45 176.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.92 -42.35 98.98 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.094 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.524 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 7.8 mm-40 -62.92 -47.57 82.69 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 121.211 0.529 . . . . 0.0 110.965 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.4 mt -69.7 -38.12 76.84 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.503 -176.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -64.45 -45.57 86.88 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -61.47 -44.14 97.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.404 177.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 51.3 tpp -55.63 -44.09 76.79 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.016 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.7 mt -65.02 -56.26 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.569 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.448 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.5 t30 -58.92 -23.7 61.57 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -172.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -66.5 -38.77 87.97 Favored 'General case' 0 N--CA 1.386 -3.663 0 C-N-CA 123.122 0.569 . . . . 0.0 111.679 175.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.627 HG11 ' SD ' ' A' ' 71' ' ' MET . 8.6 m -95.87 -18.79 6.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 120.838 0.351 . . . . 0.0 110.454 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.448 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 38.4 t70 -70.62 89.84 0.74 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.67 -178.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.37 -27.11 23.0 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.207 -176.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -82.23 -11.71 58.51 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.384 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.08 17.98 79.69 Favored Glycine 0 N--CA 1.434 -1.451 0 CA-C-O 119.457 -0.635 . . . . 0.0 114.228 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.0 p30 -81.39 -16.31 52.59 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.043 1.421 . . . . 0.0 111.871 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.78 4.71 58.94 Favored Glycine 0 N--CA 1.441 -0.968 0 C-N-CA 120.545 -0.836 . . . . 0.0 114.027 177.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.0 p -135.78 166.77 22.52 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 117.909 0.855 . . . . 0.0 111.198 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.3 mt -91.27 111.62 24.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -89.66 161.4 16.13 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 176.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.426 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 37.1 t80 -58.5 -50.11 89.85 Favored Pre-proline 0 CA--C 1.553 1.086 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.5 Cg_endo -49.23 -41.92 41.06 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.853 2.368 . . . . 0.0 112.479 174.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -70.64 -41.06 72.67 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.517 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.23 -45.0 92.31 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.729 174.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.51 -45.7 80.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.338 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.519 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 43.5 m -57.35 -54.32 48.18 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 123.618 0.574 . . . . 0.0 110.816 174.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.627 ' SD ' HG11 ' A' ' 55' ' ' VAL . 35.6 ttp -53.69 -51.72 62.32 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 123.737 0.815 . . . . 0.0 112.035 -178.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.406 ' HG2' ' CE1' ' A' ' 12' ' ' PHE . 34.2 tpp -67.74 -43.27 80.31 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.65 -28.88 69.7 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 123.726 0.641 . . . . 0.0 111.54 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 70' ' ' THR . 51.6 mtp180 -79.21 -36.39 40.23 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.177 177.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -72.79 -30.66 64.27 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 121.465 0.65 . . . . 0.0 110.809 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 56.6 ttp . . . . . 0 C--N 1.308 -1.202 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.684 -176.824 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -51.36 -50.71 58.97 Favored 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.333 0.653 . . . . 0.0 111.778 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 74' ' ' ARG . 8.2 mm-40 -60.03 -35.32 74.84 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.46 -176.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.44 HG21 HG12 ' A' ' 142' ' ' VAL . 30.3 mm -74.97 -45.04 43.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.732 -177.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -71.48 -35.86 70.96 Favored 'General case' 0 C--O 1.21 -1.021 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.401 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.426 ' CD ' HH21 ' A' ' 90' ' ' ARG . 5.6 mm-40 -61.91 -35.89 79.7 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.637 0.256 . . . . 0.0 111.597 175.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.431 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -68.64 -44.3 74.46 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 176.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -59.9 -41.67 92.17 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 121.317 0.579 . . . . 0.0 109.533 178.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.426 HH21 ' CD ' ' A' ' 87' ' ' GLU . 7.0 tmm_? -61.7 -36.82 82.0 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 125.356 1.462 . . . . 0.0 111.822 -178.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.464 HG11 ' O ' ' B' ' 92' ' ' ALA . 9.6 p -80.43 -19.01 12.05 Favored 'Isoleucine or valine' 0 C--O 1.248 0.982 0 CA-C-O 121.589 0.709 . . . . 0.0 111.066 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -88.06 -54.3 4.29 Favored 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 120.025 -0.67 . . . . 0.0 111.467 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -104.07 87.57 2.8 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.049 0.452 . . . . 0.0 110.373 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.407 ' N ' ' HD3' ' A' ' 94' ' ' LYS . 3.3 mppt? -80.11 -28.13 39.06 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.525 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -77.44 -13.24 59.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.127 -171.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.7 62.46 3.01 Favored Glycine 0 N--CA 1.431 -1.645 0 C-N-CA 120.091 -1.052 . . . . 0.0 111.542 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -96.7 -18.64 19.53 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 176.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.86 -5.01 85.9 Favored Glycine 0 N--CA 1.441 -1.0 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -177.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.604 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 61.1 m-85 -143.54 143.36 31.5 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 -178.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.482 ' HB ' HG13 ' A' ' 136' ' ' VAL . 6.3 mt -80.22 125.2 38.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.759 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.6 m -95.57 140.06 30.94 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.13 -40.25 97.05 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.576 0.35 . . . . 0.0 111.532 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.57 -37.06 80.06 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.05 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 67.5 tt0 -77.3 -36.83 53.79 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.662 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.9 tt -66.55 -36.8 83.56 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.443 ' HB2' HG21 ' A' ' 121' ' ' VAL . 2.7 tmt_? -62.0 -40.82 96.94 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -64.36 -44.95 89.83 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.328 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.564 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.2 p -66.51 -32.3 57.45 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.172 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.421 ' HG3' HD12 ' A' ' 116' ' ' LEU . 20.5 mmt -64.39 -40.12 95.2 Favored 'General case' 0 CA--C 1.5 -0.965 0 N-CA-C 111.89 0.329 . . . . 0.0 111.89 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.4 m -62.52 -35.85 80.72 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -74.45 -28.94 61.26 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.913 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 70.4 mt -90.64 -14.87 31.49 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 121.139 0.495 . . . . 0.0 110.25 -176.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.58 3.47 86.33 Favored Glycine 0 N--CA 1.436 -1.346 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.889 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.532 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 24.0 mm-40 -70.67 -30.46 67.06 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.981 0.39 . . . . 0.0 110.01 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 51.93 86.6 0.04 OUTLIER 'General case' 0 C--O 1.246 0.91 0 O-C-N 124.594 1.184 . . . . 0.0 112.569 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.421 HD12 ' HG3' ' A' ' 109' ' ' MET . 62.4 mt -113.05 148.8 34.43 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.217 -178.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 9.4 p -77.09 165.21 24.9 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.993 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.9 -40.29 97.11 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.46 -35.64 81.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.891 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.77 -55.65 16.14 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.701 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.443 HG21 ' HB2' ' A' ' 106' ' ' ARG . 15.1 m -64.16 -33.13 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.421 -178.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -63.85 -43.13 97.07 Favored 'General case' 0 CA--C 1.507 -0.68 0 C-N-CA 123.193 0.597 . . . . 0.0 109.642 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -67.36 -43.66 80.9 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.907 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.8 mtt -57.8 -48.9 78.39 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.941 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.4 mm -64.26 -43.38 97.23 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.579 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.556 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -56.24 -44.32 79.52 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 123.09 0.556 . . . . 0.0 112.182 -176.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -71.56 -31.74 67.32 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 119.924 -0.711 . . . . 0.0 110.88 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.463 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -79.5 -30.51 42.0 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.645 -178.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -72.47 91.91 1.42 Allowed 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 124.454 1.102 . . . . 0.0 108.07 173.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 68.2 mt -81.72 -42.41 19.27 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.786 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.274 -173.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -79.54 -12.05 59.87 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.892 -176.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.35 50.45 5.07 Favored Glycine 0 C--N 1.31 -0.911 0 C-N-CA 120.431 -0.89 . . . . 0.0 113.609 175.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -100.27 -15.54 18.02 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 122.074 0.94 . . . . 0.0 108.51 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 94.5 -0.1 65.33 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.604 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 24.0 mt-30 -142.29 140.92 32.35 Favored 'General case' 0 N--CA 1.429 -1.52 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 -178.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.482 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.6 OUTLIER -99.1 122.17 50.54 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -175.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.462 ' ND2' ' HG3' ' A' ' 140' ' ' GLU . 0.5 OUTLIER -85.56 171.75 11.48 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.941 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.61 ' O ' HG13 ' A' ' 142' ' ' VAL . 75.2 t80 -54.57 -47.0 73.81 Favored 'General case' 0 C--O 1.219 -0.502 0 C-N-CA 123.225 0.61 . . . . 0.0 112.325 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.76 -23.67 67.46 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.072 0.463 . . . . 0.0 112.095 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.462 ' HG3' ' ND2' ' A' ' 137' ' ' ASN . 44.5 mt-10 -86.89 -37.86 17.28 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-O 121.713 0.768 . . . . 0.0 108.977 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -70.34 -30.47 67.43 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.3 -0.864 . . . . 0.0 112.102 -179.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.61 HG13 ' O ' ' A' ' 138' ' ' TYR . 28.9 m -59.83 -35.01 57.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -76.96 -34.11 57.62 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.644 0.735 . . . . 0.0 109.41 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.463 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 92.6 mmm -76.24 -35.65 58.88 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.403 -176.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 14.6 tpt . . . . . 0 C--N 1.307 -1.26 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.354 -178.17 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 64.4 tttm . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 111.383 0.142 . . . . 0.0 111.383 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' B' ' 86' ' ' LYS . 1.6 mp0 -66.43 -41.91 88.49 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 178.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -69.8 -41.78 74.58 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.99 0.424 . . . . 0.0 110.47 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 77.3 t-105 -66.31 -22.72 66.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 122.673 1.225 . . . . 0.0 109.196 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . 0.544 ' O ' ' HG3' ' B' ' 90' ' ' GLN . 85.2 tttt -78.97 -63.59 1.38 Allowed 'General case' 0 C--N 1.267 -3.016 0 CA-C-N 115.049 -0.978 . . . . 0.0 108.808 174.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . 0.404 ' HA ' ' OE1' ' B' ' 90' ' ' GLN . 31.1 m170 -63.71 -52.14 61.87 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -170.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.12 -29.94 69.82 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.164 0.507 . . . . 0.0 111.126 -176.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 42.8 mm -83.14 -28.62 7.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.22 -178.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . 0.544 ' HG3' ' O ' ' B' ' 86' ' ' LYS . 50.7 mt-30 -62.65 -46.48 88.02 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 174.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.532 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 24.6 tptm -64.68 -25.91 68.15 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.082 -1.417 . . . . 0.0 112.164 -178.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . 0.464 ' O ' HG11 ' A' ' 91' ' ' VAL . . . -76.83 -10.85 59.66 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -176.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 25.3 tptp . . . . . 0 C--N 1.313 -1.006 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -172.195 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.439 ' HB3' HD11 ' A' ' 9' ' ' ILE . 8.9 tp . . . . . 0 N--CA 1.42 -1.963 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.6 p -73.17 151.47 41.5 Favored 'General case' 0 N--CA 1.424 -1.727 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.271 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -53.92 -43.12 69.47 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -173.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -70.0 -33.38 71.96 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.853 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -61.64 -48.89 78.83 Favored 'General case' 0 C--O 1.212 -0.884 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 175.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.459 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 43.3 mt -60.51 -33.66 55.25 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.683 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.601 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.428 ' O ' ' HB2' ' A' ' 13' ' ' LYS . . . -65.29 -41.05 94.53 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.534 0.683 . . . . 0.0 110.25 175.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -65.88 -37.78 87.04 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.355 0.598 . . . . 0.0 109.634 175.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.538 ' HZ ' ' SD ' ' A' ' 76' ' ' MET . 46.4 m-85 -69.67 -25.05 63.71 Favored 'General case' 0 C--O 1.176 -2.791 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.885 177.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 33.1 mmtp -60.28 -47.78 84.56 Favored 'General case' 0 C--O 1.25 1.125 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 172.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.55 -55.39 20.8 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.379 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.89 82.32 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.166 -0.925 . . . . 0.0 113.136 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -65.6 -45.79 81.82 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -69.14 -16.92 63.76 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.681 -177.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.48 -42.27 99.36 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 171.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.416 ' CD2' HG21 ' A' ' 35' ' ' VAL . 65.4 m-85 -81.32 -51.36 8.45 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.825 178.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -70.64 98.89 1.57 Allowed 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.801 0.81 . . . . 0.0 110.551 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mmtm -77.56 -15.82 59.01 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 114.793 -1.094 . . . . 0.0 113.366 -174.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.482 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 11.1 m-20 -95.42 -14.38 23.84 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.648 -176.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.26 40.34 87.59 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.482 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 5.5 p30 -113.12 -15.23 12.82 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -175.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.23 14.08 60.91 Favored Glycine 0 C--N 1.313 -0.696 0 C-N-CA 120.961 -0.637 . . . . 0.0 113.539 178.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.5 p -134.76 131.39 37.5 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 174.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.8 mt -104.72 121.34 56.45 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.3 p -92.74 171.99 8.64 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.689 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.4 HG23 HD12 ' A' ' 52' ' ' ILE . 11.7 p -59.81 -35.34 74.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.558 0.694 . . . . 0.0 109.648 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -54.43 -51.0 66.33 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.109 1.364 . . . . 0.0 110.506 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -70.84 -36.38 72.86 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.272 -175.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 85.5 mt -61.65 -51.22 69.36 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 175.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.1 -29.45 74.45 Favored Glycine 0 N--CA 1.441 -1.021 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.428 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -61.18 -53.28 58.88 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 116.975 0.388 . . . . 0.0 110.433 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.416 HG21 ' CD2' ' A' ' 19' ' ' PHE . 33.9 m -71.02 -31.54 45.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.349 -177.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.451 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 64.9 mtt -68.14 -37.74 81.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.221 177.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -65.11 -31.9 73.34 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 177.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.6 m -75.33 -13.86 60.44 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.545 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -104.57 6.14 34.35 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.167 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.02 23.14 64.32 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 116.0 -0.545 . . . . 0.0 113.524 178.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.505 ' HG3' ' HD3' ' A' ' 43' ' ' PRO . 5.4 tp-100 -120.8 131.53 54.51 Favored 'General case' 0 N--CA 1.424 -1.754 0 O-C-N 122.226 -0.573 . . . . 0.0 110.474 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.46 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -123.29 79.32 53.11 Favored Pre-proline 0 C--N 1.296 -1.737 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.505 ' HD3' ' HG3' ' A' ' 41' ' ' GLN . 31.8 Cg_exo -65.89 164.24 27.89 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 122.188 1.925 . . . . 0.0 110.84 176.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.436 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 46.9 p -76.75 166.02 23.94 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 -179.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -60.07 -36.47 77.42 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.89 -45.78 93.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.66 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.436 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 34.1 mm-40 -60.49 -43.45 96.98 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.443 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.05 -46.8 76.49 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.95 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 47.1 tp60 -68.64 -42.65 77.68 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -61.39 -42.24 98.4 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.375 0.607 . . . . 0.0 109.854 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 45.0 ttm -54.31 -46.85 72.91 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.506 177.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.4 HD12 HG23 ' A' ' 29' ' ' THR . 40.2 mt -67.54 -53.61 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.178 178.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.401 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 12.7 t30 -54.99 -27.54 44.98 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -172.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -66.65 -42.3 86.87 Favored 'General case' 0 N--CA 1.386 -3.658 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 178.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.458 HG11 ' SD ' ' A' ' 71' ' ' MET . 4.3 m -94.82 -14.59 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-O 120.863 0.363 . . . . 0.0 111.321 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.401 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 54.0 t0 -69.28 104.83 2.33 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.54 -35.61 22.74 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.364 -173.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -91.01 -10.55 41.86 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.593 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.65 52.21 36.06 Favored Glycine 0 C--O 1.239 0.429 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.768 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -107.69 -13.89 14.93 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.537 0.208 . . . . 0.0 111.452 -178.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.9 -3.27 33.79 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.239 -0.982 . . . . 0.0 113.563 179.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.9 p -127.83 151.25 49.28 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 117.504 0.652 . . . . 0.0 110.84 178.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.1 mt -91.58 104.69 15.78 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.086 0 N-CA-C 104.198 -2.519 . . . . 0.0 104.198 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.13 158.82 20.29 Favored 'General case' 0 C--N 1.283 -2.303 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -175.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.426 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 52.0 t80 -51.46 -51.69 66.85 Favored Pre-proline 0 CA--C 1.554 1.122 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -176.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.41 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 8.5 Cg_endo -50.52 -44.57 39.18 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.774 2.316 . . . . 0.0 112.838 175.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -69.04 -36.94 78.27 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.537 0.684 . . . . 0.0 110.304 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -63.54 -39.64 94.94 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.092 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 87.2 mt -65.86 -44.02 86.67 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.141 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 93.2 m -54.99 -49.12 72.27 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 123.867 0.73 . . . . 0.0 109.656 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.458 ' SD ' HG11 ' A' ' 55' ' ' VAL . 17.9 ttp -54.41 -52.76 60.71 Favored 'General case' 0 C--O 1.199 -1.591 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.861 176.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.0 mmt -64.23 -42.67 96.46 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -174.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.39 -35.25 71.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.625 0.726 . . . . 0.0 110.486 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 -83.8 -32.79 25.16 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.126 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -83.29 -35.57 25.17 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 123.077 0.551 . . . . 0.0 112.22 -168.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.538 ' SD ' ' HZ ' ' A' ' 12' ' ' PHE . 63.6 mtm . . . . . 0 C--N 1.308 -1.226 0 CA-C-O 121.489 0.662 . . . . 0.0 110.542 -178.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 . . . . . 0 N--CA 1.467 0.398 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -64.73 -27.45 68.92 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 121.056 0.455 . . . . 0.0 111.542 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.66 -27.25 55.54 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.858 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 27.2 mm -72.32 -38.61 61.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 174.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -61.74 -42.77 99.4 Favored 'General case' 0 C--O 1.21 -0.996 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.296 174.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -56.33 -51.75 67.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.432 ' HA ' HG12 ' A' ' 91' ' ' VAL . . . -59.04 -43.64 91.68 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.197 179.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.36 -54.02 49.18 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.68 -43.67 69.09 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 125.166 1.386 . . . . 0.0 112.707 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.432 HG12 ' HA ' ' A' ' 88' ' ' ALA . 11.9 p -72.15 -25.94 24.28 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.536 -176.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -82.06 -56.07 4.18 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 175.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -84.23 85.07 7.41 Favored 'General case' 0 C--O 1.252 1.212 0 CA-C-O 122.124 0.964 . . . . 0.0 110.663 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -78.65 -35.02 45.97 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 114.447 -1.251 . . . . 0.0 112.798 -178.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -73.32 -13.57 61.14 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 121.186 0.517 . . . . 0.0 111.003 -178.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.63 52.6 9.62 Favored Glycine 0 N--CA 1.43 -1.715 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -87.94 -18.62 28.72 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.22 6.07 88.34 Favored Glycine 0 CA--C 1.501 -0.805 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.558 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 98.5 m-85 -147.34 149.85 33.6 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 -178.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.51 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.9 mt -93.48 123.3 45.52 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.875 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 175.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 29.9 t -104.06 151.94 22.65 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 123.723 0.809 . . . . 0.0 109.451 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.31 -34.91 79.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.776 178.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.25 86.23 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.089 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.561 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 2.1 tp10 -68.33 -41.17 81.19 Favored 'General case' 0 CA--C 1.503 -0.856 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.437 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -61.43 -39.32 90.37 Favored 'General case' 0 N--CA 1.427 -1.601 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -175.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.708 ' HG3' HG21 ' A' ' 121' ' ' VAL . 19.5 mtm180 -56.65 -42.8 79.57 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.401 172.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.561 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 50.3 m170 -54.52 -56.04 22.97 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.584 0.753 . . . . 0.0 110.697 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.406 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.2 p -70.94 -35.65 60.5 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.137 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.187 -174.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 22.7 mmt -63.49 -45.28 91.44 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -177.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.8 p -65.23 -36.01 82.82 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-O 121.135 0.493 . . . . 0.0 110.129 176.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -66.0 -32.58 74.14 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.696 178.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 78.9 mt -85.05 -17.91 36.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.824 -177.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 80.33 23.84 60.16 Favored Glycine 0 N--CA 1.435 -1.414 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.451 -177.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -84.99 -35.22 22.11 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 55.4 tptt 47.58 88.25 0.02 OUTLIER 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.648 1.579 . . . . 0.0 113.611 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 64.6 mt -101.06 155.63 17.88 Favored 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 24.3 p -75.78 166.09 24.06 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 175.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -63.52 -34.14 77.14 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -64.13 -44.58 91.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.159 176.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -70.5 -35.66 73.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.855 -174.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.708 HG21 ' HG3' ' A' ' 106' ' ' ARG . 19.2 m -72.52 -33.27 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.897 176.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -70.94 -41.86 70.57 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.284 -177.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -68.55 -31.08 70.04 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.016 177.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.4 mtt -58.8 -48.53 80.96 Favored 'General case' 0 CA--C 1.497 -1.071 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.263 175.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.11 -46.57 96.18 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.533 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.656 178.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -55.67 -44.41 77.26 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.25 0.62 . . . . 0.0 111.48 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -66.17 -28.82 69.07 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.094 0.558 . . . . 0.0 111.37 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.478 ' HB1' HG21 ' A' ' 136' ' ' VAL . . . -97.52 -20.57 17.64 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.624 -0.431 . . . . 0.0 112.05 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.404 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 5.4 t70 -70.24 93.22 0.82 Allowed 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 124.052 0.941 . . . . 0.0 110.244 177.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.1 mt -84.53 -40.31 15.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.229 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -83.76 -10.99 57.72 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.259 0.552 . . . . 0.0 112.305 -172.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.404 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 75.64 55.75 4.87 Favored Glycine 0 C--N 1.307 -1.083 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.587 176.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -111.84 -17.08 13.02 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 177.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.32 4.62 60.94 Favored Glycine 0 N--CA 1.439 -1.136 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.558 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 26.7 mt-30 -147.76 145.12 28.69 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.51 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.0 OUTLIER -102.81 120.4 52.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -176.094 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -86.05 168.3 14.22 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.433 ' O ' HG13 ' A' ' 142' ' ' VAL . 68.2 t80 -55.62 -46.83 77.33 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.971 0.909 . . . . 0.0 112.852 -174.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.476 ' HA ' HG22 ' A' ' 142' ' ' VAL . 28.9 mm-40 -67.45 -26.61 66.48 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -178.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -73.62 -44.87 55.88 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -63.95 -38.7 92.04 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.759 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.476 HG22 ' HA ' ' A' ' 139' ' ' GLU . 15.9 m -66.85 -35.02 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.633 177.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -72.73 -37.98 67.56 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.412 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 1.5 tmt? -72.54 -50.88 22.6 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.917 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.881 0 C-N-CA 123.167 0.587 . . . . 0.0 110.548 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 84.2 tttt . . . . . 0 C--O 1.238 0.466 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -77.16 -45.08 27.94 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 175.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.73 -49.98 74.76 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.512 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -60.22 -38.14 82.47 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -63.38 -29.97 71.18 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 121.364 0.602 . . . . 0.0 110.897 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -84.12 -43.56 14.91 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.091 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.0 -56.76 18.05 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 123.732 0.813 . . . . 0.0 112.312 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 74.2 mt -62.15 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.086 0.469 . . . . 0.0 110.672 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -66.64 -36.31 82.28 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.286 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -73.16 -38.58 66.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.37 -41.2 94.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.978 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 121.079 0.466 . . . . 0.0 110.034 176.267 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.605 ' HB3' ' HB2' ' A' ' 8' ' ' GLN . 2.9 mm? . . . . . 0 N--CA 1.416 -2.156 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.437 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 25.0 p -79.96 160.89 25.78 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -62.19 -31.4 71.91 Favored 'General case' 0 C--O 1.203 -1.375 0 C-N-CA 121.218 -0.193 . . . . 0.0 110.754 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 11' ' ' GLU . 1.8 mp0 -63.41 -42.34 98.76 Favored 'General case' 0 C--N 1.314 -0.974 0 O-C-N 123.5 0.5 . . . . 0.0 111.057 177.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.605 ' HB2' ' HB3' ' A' ' 4' ' ' LEU . 27.6 mm-40 -64.67 -47.9 76.73 Favored 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.8 mt -56.8 -39.33 63.58 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.31 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.4 89.58 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 123.521 0.728 . . . . 0.0 111.069 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 7' ' ' GLU . 60.2 mm-40 -61.85 -44.34 97.03 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.554 0.692 . . . . 0.0 109.444 176.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -68.28 -29.76 68.62 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.444 -178.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -68.42 -33.54 74.39 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.982 175.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -68.49 -50.03 55.36 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.7 -43.09 72.2 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.771 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.41 ' HZ ' ' C ' ' A' ' 25' ' ' GLY . 70.2 t80 -59.17 -44.0 92.14 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.777 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.5 m -74.52 -20.87 59.81 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.733 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.256 2.9 tm? -68.67 -50.65 49.38 Favored 'General case' 0 CA--C 1.483 -1.63 0 N-CA-C 106.198 -1.779 . . . . 0.0 106.198 175.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.469 ' CZ ' HD23 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -77.39 -41.1 41.35 Favored 'General case' 0 N--CA 1.383 -3.809 0 CA-C-N 111.616 -2.538 . . . . 0.0 111.62 -167.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -69.97 96.28 1.02 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -74.13 -36.95 64.22 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.192 -0.913 . . . . 0.0 113.291 -174.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -93.08 -13.57 28.4 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.231 -177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.07 57.4 8.64 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 121.313 -0.47 . . . . 0.0 113.593 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -113.74 -11.96 12.84 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 116.913 0.356 . . . . 0.0 111.053 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.41 ' C ' ' HZ ' ' A' ' 16' ' ' PHE . . . 102.66 5.75 47.73 Favored Glycine 0 N--CA 1.43 -1.704 0 C-N-CA 119.833 -1.175 . . . . 0.0 113.118 -178.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.434 HG22 ' HA ' ' A' ' 64' ' ' ASP . 24.0 p -145.57 156.39 43.66 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 117.721 0.761 . . . . 0.0 111.011 173.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 72.5 mt -107.56 109.12 27.04 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.6 p -84.96 167.93 15.44 Favored 'General case' 0 C--N 1.288 -2.072 0 O-C-N 122.202 -0.312 . . . . 0.0 110.962 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -56.56 -34.36 67.03 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 123.304 0.642 . . . . 0.0 111.226 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -59.65 -42.15 92.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.819 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -70.25 -33.31 71.46 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.933 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.568 HD11 HG13 ' A' ' 52' ' ' ILE . 65.2 mt -56.25 -59.73 4.52 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 174.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.14 -26.8 64.1 Favored Glycine 0 C--O 1.19 -2.652 0 CA-C-N 114.599 -1.182 . . . . 0.0 112.968 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.4 m -65.24 -53.55 42.66 Favored 'General case' 0 CA--C 1.558 1.286 0 CA-C-N 117.734 0.767 . . . . 0.0 110.705 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.1 m -72.27 -32.56 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.32 0.581 . . . . 0.0 109.861 -178.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.421 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 66.9 mtp -72.33 -29.24 63.64 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.589 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -68.15 -36.12 79.15 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 175.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -63.43 -27.46 69.3 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.02 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.565 HD11 ' HD2' ' B' ' 91' ' ' LYS . 4.6 mm? -85.51 -13.54 48.71 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.105 0.478 . . . . 0.0 111.052 177.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.14 16.81 36.74 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.153 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -106.16 130.56 54.02 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -124.38 83.99 56.84 Favored Pre-proline 0 C--N 1.3 -1.545 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.965 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.559 ' HG2' HD21 ' A' ' 48' ' ' LEU . 6.2 Cg_endo -85.73 164.55 10.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.46 2.107 . . . . 0.0 111.117 173.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.0 p -86.9 169.13 12.78 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 120.932 0.396 . . . . 0.0 111.349 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -58.71 -45.58 89.24 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 125.275 1.43 . . . . 0.0 110.229 -176.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.88 95.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.512 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.435 ' O ' ' HG3' ' A' ' 51' ' ' MET . 40.0 mt-10 -61.67 -47.22 86.34 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.006 0.432 . . . . 0.0 110.128 178.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.559 HD21 ' HG2' ' A' ' 43' ' ' PRO . 95.8 mt -64.82 -38.39 90.82 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.755 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -61.1 -46.05 92.21 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.993 176.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -62.8 -39.93 95.79 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 123.37 0.419 . . . . 0.0 111.241 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.435 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 67.9 mtt -60.78 -45.76 93.11 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.024 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.568 HG13 HD11 ' A' ' 32' ' ' LEU . 23.4 mt -73.48 -36.81 49.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.77 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.403 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.6 t30 -57.9 -22.46 48.58 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 123.086 0.554 . . . . 0.0 112.346 -176.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -64.09 -32.82 74.52 Favored 'General case' 0 N--CA 1.386 -3.651 0 C-N-CA 124.261 1.024 . . . . 0.0 111.398 176.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.482 ' CG1' ' HB2' ' A' ' 71' ' ' MET . 10.9 m -107.53 -22.81 4.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-O 121.259 0.552 . . . . 0.0 110.086 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.475 ' HB2' HG22 ' A' ' 52' ' ' ILE . 42.3 t0 -73.08 116.02 13.11 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.48 -174.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.4 -16.07 38.38 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.673 177.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -88.88 -11.08 45.65 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.081 -175.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 56.32 29.79 57.29 Favored Glycine 0 CA--C 1.525 0.664 0 CA-C-N 115.479 -0.782 . . . . 0.0 113.354 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 37.2 p30 -116.33 -12.8 11.07 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 108.78 24.69 5.98 Favored Glycine 0 N--CA 1.44 -1.068 0 C-N-CA 119.489 -1.339 . . . . 0.0 113.582 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.3 p -120.24 131.6 55.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 117.581 0.691 . . . . 0.0 111.814 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.9 mt -94.67 110.21 23.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 170.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.434 ' HA ' HG22 ' A' ' 26' ' ' THR . 5.1 m-20 -90.98 158.01 16.96 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 178.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.435 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 21.9 t80 -55.8 -47.84 97.86 Favored Pre-proline 0 CA--C 1.555 1.172 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -176.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.435 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.5 Cg_endo -50.28 -44.6 37.92 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.607 2.205 . . . . 0.0 112.173 172.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -67.08 -42.3 84.88 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.752 0.421 . . . . 0.0 110.219 -179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.51 -50.41 71.88 Favored 'General case' 0 C--O 1.244 0.79 0 C-N-CA 124.358 1.063 . . . . 0.0 109.55 176.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.4 mt -61.04 -40.75 94.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.764 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.0 m -59.26 -48.01 83.22 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.566 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.482 ' HB2' ' CG1' ' A' ' 55' ' ' VAL . 29.9 ttp -57.89 -49.99 74.84 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.938 178.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 24.4 mmt -67.39 -43.42 81.39 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 120.252 -0.579 . . . . 0.0 112.43 -176.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.48 -31.36 70.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.041 0.448 . . . . 0.0 111.216 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -80.75 -40.89 24.41 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-O 121.023 0.439 . . . . 0.0 110.871 176.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -77.99 -38.07 45.8 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.146 0.498 . . . . 0.0 110.444 -169.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 46.7 mtm . . . . . 0 C--N 1.318 -0.761 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.048 -179.488 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.437 -1.081 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -64.35 -42.48 96.22 Favored 'General case' 0 CA--C 1.507 -0.691 0 C-N-CA 120.074 -0.65 . . . . 0.0 110.126 172.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -58.07 -40.11 80.22 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.887 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 44.9 mm -67.4 -44.51 86.93 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.172 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -71.7 -39.78 69.96 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.491 -178.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -64.82 -40.66 95.56 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 120.827 0.346 . . . . 0.0 110.876 177.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.466 ' HB1' HD12 ' B' ' 89' ' ' ILE . . . -68.02 -35.94 79.13 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.241 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -65.62 -48.58 71.75 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -55.42 -32.63 62.84 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 179.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 13.8 p -74.62 -28.84 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.334 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.439 ' O ' ' HG2' ' A' ' 104' ' ' GLU . 88.3 m-85 -89.19 -35.56 16.15 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.417 0.627 . . . . 0.0 110.23 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -88.82 69.31 8.63 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 174.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -66.6 -34.51 78.04 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 113.821 -1.536 . . . . 0.0 112.771 -171.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -90.22 -7.18 54.18 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.422 0.629 . . . . 0.0 110.476 -176.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.06 55.91 6.78 Favored Glycine 0 CA--C 1.502 -0.764 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -104.19 -18.59 14.44 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.973 0.416 . . . . 0.0 110.181 -175.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.9 10.56 66.58 Favored Glycine 0 N--CA 1.436 -1.36 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.036 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -156.32 141.49 17.38 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 120.851 0.357 . . . . 0.0 110.739 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.487 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.1 mt -97.49 137.02 26.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.241 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 61.9 p -114.99 158.16 22.44 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.496 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.405 ' HB1' HG23 ' A' ' 121' ' ' VAL . . . -66.45 -34.84 78.84 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 121.075 0.464 . . . . 0.0 109.879 178.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.89 -52.01 67.27 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.859 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.697 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 41.1 tp10 -65.61 -43.3 90.03 Favored 'General case' 0 CA--C 1.482 -1.636 0 C-N-CA 120.424 -0.51 . . . . 0.0 111.554 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.488 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.1 tt -57.38 -39.28 75.72 Favored 'General case' 0 N--CA 1.423 -1.814 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 -173.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.615 ' HG3' HG21 ' A' ' 121' ' ' VAL . 52.8 mtp180 -65.77 -34.66 78.69 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 173.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.697 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 30.7 m170 -58.98 -55.57 33.46 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.669 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -64.81 -37.74 80.95 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.392 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.732 -176.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.488 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.2 mmt -60.3 -37.94 82.12 Favored 'General case' 0 C--O 1.251 1.149 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 65.1 m -62.25 -40.58 96.67 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.18 177.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.95 -17.06 53.94 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.251 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.669 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 97.2 mt -92.18 -14.1 29.59 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 121.2 0.524 . . . . 0.0 111.83 -176.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 82.2 6.1 89.08 Favored Glycine 0 N--CA 1.437 -1.274 0 C-N-CA 120.272 -0.966 . . . . 0.0 111.418 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.41 ' HB2' ' SD ' ' A' ' 109' ' ' MET . 47.2 mm-40 -73.2 -44.08 60.33 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 67.1 mttm 57.58 90.74 0.04 OUTLIER 'General case' 0 C--O 1.242 0.668 0 O-C-N 124.763 1.29 . . . . 0.0 111.026 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.427 HD22 ' HG2' ' A' ' 120' ' ' GLU . 76.4 mt -125.89 131.28 52.38 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 -178.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 17.5 p -83.05 176.89 8.88 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.638 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -60.22 -27.74 67.44 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -172.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -68.75 -51.3 42.67 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 118.825 0.739 . . . . 0.0 111.011 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.427 ' HG2' HD22 ' A' ' 116' ' ' LEU . 7.2 tp10 -58.19 -49.78 75.83 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.945 -177.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.615 HG21 ' HG3' ' A' ' 106' ' ' ARG . 4.3 m -69.99 -29.03 38.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.845 -176.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -65.08 -46.95 79.02 Favored 'General case' 0 CA--C 1.485 -1.52 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -63.17 -36.73 84.59 Favored 'General case' 0 N--CA 1.443 -0.79 0 O-C-N 124.157 0.911 . . . . 0.0 109.79 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.9 mtt -59.88 -49.83 76.16 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.14 176.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 47.3 mm -69.03 -54.0 22.7 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.47 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.29 -178.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -57.15 -41.2 78.69 Favored 'General case' 0 C--N 1.309 -1.167 0 C-N-CA 124.806 1.242 . . . . 0.0 112.802 -172.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -81.87 -21.82 37.25 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.925 -0.71 . . . . 0.0 111.698 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -80.08 -36.45 35.5 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 176.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -61.83 104.44 0.45 Allowed 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 125.707 1.603 . . . . 0.0 109.221 175.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 72.1 mt -83.28 -45.25 18.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.65 -175.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -82.26 -11.01 58.91 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.879 -0.601 . . . . 0.0 112.29 -170.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.18 53.95 3.73 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.718 177.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -115.68 -17.59 11.06 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 121.566 0.698 . . . . 0.0 110.435 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.86 9.85 62.07 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -144.95 125.97 14.53 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.487 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.0 OUTLIER -90.56 117.9 34.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 123.455 0.472 . . . . 0.0 111.702 -178.362 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -84.79 175.66 9.01 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.5 178.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.541 ' O ' HG13 ' A' ' 142' ' ' VAL . 84.2 t80 -62.3 -43.26 99.24 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.709 -177.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -63.77 -21.99 66.69 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -87.78 -35.62 17.76 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -72.98 -36.66 67.13 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.72 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.541 HG13 ' O ' ' A' ' 138' ' ' TYR . 33.8 m -59.48 -35.44 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-O 120.995 0.426 . . . . 0.0 111.7 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -70.51 -29.62 66.18 Favored 'General case' 0 C--O 1.205 -1.241 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.977 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 73.2 mtp -57.78 -40.38 79.71 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.794 0.438 . . . . 0.0 112.09 -177.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 51.8 tpp . . . . . 0 C--N 1.321 -0.669 0 CA-C-O 121.22 0.533 . . . . 0.0 110.555 -178.831 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 95.3 mttt . . . . . 0 N--CA 1.442 -0.863 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -82.42 -37.22 25.81 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.96 -47.55 85.91 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.728 0.642 . . . . 0.0 109.679 176.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.643 ' O ' HG12 ' B' ' 89' ' ' ILE . 38.8 m95 -63.71 -43.12 97.53 Favored 'General case' 0 C--O 1.199 -1.573 0 CA-C-O 119.415 -0.326 . . . . 0.0 111.486 175.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -53.09 -51.75 60.82 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.87 0.843 . . . . 0.0 109.191 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -58.24 -45.66 87.35 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 113.43 -1.714 . . . . 0.0 109.595 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.25 -49.4 75.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.13 178.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.643 HG12 ' O ' ' B' ' 85' ' ' TRP . 51.8 mm -57.71 -51.44 70.17 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.468 0 C-N-CA 123.347 0.659 . . . . 0.0 109.312 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -61.8 -28.94 69.82 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.239 -177.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.565 ' HD2' HD11 ' A' ' 39' ' ' LEU . 4.5 tppp? -81.71 -53.29 6.34 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 120.983 0.421 . . . . 0.0 110.975 175.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.93 -44.89 68.69 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -174.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp . . . . . 0 C--N 1.317 -0.831 0 CA-C-O 121.801 0.81 . . . . 0.0 110.222 -175.061 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.448 ' HB3' HD11 ' A' ' 9' ' ' ILE . 14.4 tp . . . . . 0 N--CA 1.422 -1.861 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.41 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 10.0 p -68.15 142.87 55.61 Favored 'General case' 0 N--CA 1.424 -1.726 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.632 178.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -59.18 -33.29 70.77 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 123.936 0.894 . . . . 0.0 112.481 -171.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 34.2 tt0 -66.38 -41.5 89.32 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.23 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.41 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 12.3 mm100 -67.69 -40.66 84.35 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.576 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 63.5 mt -58.12 -41.38 80.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.926 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.49 95.53 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 121.51 0.671 . . . . 0.0 110.921 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 7' ' ' GLU . 30.3 mt-10 -69.89 -30.96 68.52 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.727 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -75.71 -23.77 56.13 Favored 'General case' 0 C--O 1.189 -2.1 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.979 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.576 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -63.38 -46.75 85.03 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 120.838 0.351 . . . . 0.0 110.762 176.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -68.34 -40.06 81.71 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.132 -0.627 . . . . 0.0 111.529 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.04 -38.91 89.56 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-O 121.226 0.536 . . . . 0.0 109.803 178.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -60.06 -46.57 89.1 Favored 'General case' 0 C--O 1.2 -1.548 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.982 176.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.1 m -69.36 -17.2 63.66 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.374 -178.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.72 -33.48 64.38 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 176.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.553 ' CD2' HG21 ' A' ' 35' ' ' VAL . 20.4 m-85 -89.86 -38.61 13.62 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.821 178.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -80.79 97.93 7.56 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 176.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -75.1 -6.92 52.08 Favored 'General case' 0 C--N 1.288 -2.076 0 CA-C-N 115.265 -0.879 . . . . 0.0 113.223 -176.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.428 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 18.9 m-20 -102.67 -14.53 16.66 Favored 'General case' 0 C--O 1.244 0.778 0 C-N-CA 119.379 -0.928 . . . . 0.0 109.38 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.78 45.92 94.21 Favored Glycine 0 C--N 1.339 0.722 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -175.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.428 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 2.7 p30 -113.3 -16.24 12.54 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -173.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.23 4.79 50.25 Favored Glycine 0 C--N 1.309 -0.935 0 C-N-CA 121.149 -0.548 . . . . 0.0 113.355 178.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 79.9 p -132.92 139.32 47.29 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 117.458 0.629 . . . . 0.0 109.63 173.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.9 mt -112.04 129.82 66.82 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.8 p -99.28 174.58 6.23 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.908 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.4 p -66.18 -31.25 71.97 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 121.611 0.72 . . . . 0.0 109.866 176.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -61.56 -50.62 71.91 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.439 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.32 -42.91 92.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.817 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.0 mt -56.78 -53.37 58.56 Favored 'General case' 0 C--O 1.22 -0.452 0 O-C-N 123.573 0.546 . . . . 0.0 111.273 177.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.74 -37.43 94.35 Favored Glycine 0 C--O 1.226 -0.364 0 C-N-CA 120.201 -0.999 . . . . 0.0 112.837 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 70.3 m -62.69 -46.19 89.27 Favored 'General case' 0 C--O 1.25 1.114 0 CA-C-N 116.948 0.374 . . . . 0.0 111.339 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.553 HG21 ' CD2' ' A' ' 19' ' ' PHE . 32.9 m -71.17 -34.05 53.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 C-N-CA 120.164 -0.614 . . . . 0.0 110.56 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.645 ' HB3' ' O ' ' A' ' 41' ' ' GLN . 62.1 mtt -66.99 -36.04 81.28 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.418 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -62.34 -41.31 98.47 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.288 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.9 m -67.68 -27.4 66.81 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.998 176.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 97.4 mt -82.47 -10.5 59.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.803 0.335 . . . . 0.0 111.125 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.83 24.65 48.6 Favored Glycine 0 N--CA 1.439 -1.148 0 C-N-CA 121.169 -0.539 . . . . 0.0 112.815 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.645 ' O ' ' HB3' ' A' ' 36' ' ' MET . 48.5 tt0 -155.23 100.26 2.14 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -122.26 92.59 48.89 Favored Pre-proline 0 C--N 1.304 -1.402 0 C-N-CA 119.265 -0.974 . . . . 0.0 113.443 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.557 ' HD2' ' SD ' ' A' ' 36' ' ' MET . 50.2 Cg_exo -56.8 161.62 9.97 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 123.404 2.736 . . . . 0.0 111.695 171.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.484 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 19.1 p -74.6 160.25 31.1 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -176.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -51.9 -44.45 63.8 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 124.175 0.99 . . . . 0.0 112.613 -177.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.69 76.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.062 0.458 . . . . 0.0 110.962 -178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 51' ' ' MET . 39.9 mm-40 -72.78 -42.75 63.61 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.45 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 44' ' ' THR . 79.2 mt -62.63 -39.53 94.14 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.549 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.9 tp60 -67.22 -35.15 78.99 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.732 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.19 -39.17 78.84 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 123.285 0.366 . . . . 0.0 110.128 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.461 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 61.5 mtt -57.09 -47.31 81.34 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.027 174.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.9 mt -59.45 -50.35 80.24 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.247 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.445 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 12.1 t30 -63.04 -15.69 57.34 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -173.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -71.16 -39.24 72.05 Favored 'General case' 0 N--CA 1.384 -3.732 0 O-C-N 121.759 -0.588 . . . . 0.0 110.275 175.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.409 HG11 ' SD ' ' A' ' 71' ' ' MET . 26.0 m -99.57 -20.69 5.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.307 -177.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.445 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 46.7 t0 -68.04 99.3 0.85 Allowed 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.258 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.45 -29.68 22.63 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.799 -173.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -91.03 -9.79 44.56 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.967 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.94 46.77 70.49 Favored Glycine 0 N--CA 1.441 -0.987 0 CA-C-N 115.399 -0.819 . . . . 0.0 113.255 174.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -101.91 -9.43 20.7 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.308 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.84 -6.3 43.89 Favored Glycine 0 N--CA 1.44 -1.053 0 C-N-CA 120.537 -0.839 . . . . 0.0 113.596 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.8 p -130.01 161.71 30.34 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-N 117.489 0.645 . . . . 0.0 110.991 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 26' ' ' THR . 29.1 mt -99.05 119.37 46.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.576 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 7.4 t0 -89.27 161.72 16.24 Favored 'General case' 0 C--N 1.292 -1.922 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.407 ' CZ ' HD21 ' A' ' 69' ' ' LEU . 54.7 t80 -53.53 -53.58 55.28 Favored Pre-proline 0 CA--C 1.569 1.702 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -176.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.576 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 8.7 Cg_endo -50.76 -38.45 56.65 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 123.224 2.616 . . . . 0.0 113.603 174.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -69.62 -37.43 76.83 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.796 0.808 . . . . 0.0 109.688 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -67.63 -39.07 84.66 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.327 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.407 HD21 ' CZ ' ' A' ' 65' ' ' PHE . 78.2 mt -62.68 -39.72 94.87 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.492 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.7 m -56.07 -48.34 76.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.301 0.572 . . . . 0.0 109.634 176.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.409 ' SD ' HG11 ' A' ' 55' ' ' VAL . 28.3 ttp -60.67 -42.47 97.15 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.596 179.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.404 ' O ' ' HB3' ' A' ' 75' ' ' LYS . 20.9 mmt -73.98 -36.18 64.53 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.26 -41.05 97.12 Favored 'General case' 0 C--O 1.21 -1.005 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 175.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -63.06 -30.03 71.28 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.346 175.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 72' ' ' MET . 37.3 ttmt -63.78 -41.03 98.03 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 121.151 0.5 . . . . 0.0 109.934 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.5 mtm . . . . . 0 C--N 1.31 -1.126 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.564 -177.208 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 . . . . . 0 C--O 1.215 -0.74 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.637 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 2.2 mp0 -46.87 -57.31 5.06 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 125.757 1.623 . . . . 0.0 110.348 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.59 -45.87 70.86 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.421 -175.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.8 mm -73.67 -35.7 44.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 120.704 0.287 . . . . 0.0 111.393 -174.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -74.68 -32.42 62.2 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -62.04 -45.45 93.51 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 176.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.401 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -67.02 -38.66 86.34 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 113.964 -1.471 . . . . 0.0 111.261 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -66.4 -41.67 88.98 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -53.87 -40.46 66.56 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 111.284 177.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 88' ' ' ALA . 11.6 p -75.58 -29.2 20.5 Favored 'Isoleucine or valine' 0 C--O 1.246 0.911 0 CA-C-O 120.917 0.389 . . . . 0.0 111.188 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -77.32 -62.71 1.57 Allowed 'General case' 0 C--O 1.21 -1.008 0 C-N-CA 119.689 -0.805 . . . . 0.0 111.084 178.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -85.84 94.75 9.23 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.764 0.792 . . . . 0.0 111.704 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.49 ' HZ1' ' HB ' ' A' ' 108' ' ' VAL . 43.0 mttp -80.44 -17.47 51.64 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 114.912 -1.04 . . . . 0.0 113.367 -178.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -92.65 -12.23 32.12 Favored 'General case' 0 CA--C 1.499 -0.994 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -176.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.95 44.54 30.08 Favored Glycine 0 N--CA 1.444 -0.785 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -93.43 -18.48 22.29 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.0 17.32 74.91 Favored Glycine 0 C--O 1.241 0.537 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.539 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 79.3 m-85 -150.0 152.61 35.18 Favored 'General case' 0 N--CA 1.437 -1.1 0 C-N-CA 124.617 1.167 . . . . 0.0 108.437 -177.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.491 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.3 mt -109.61 131.67 59.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.303 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 174.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.5 p -110.32 156.33 20.88 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.19 -41.58 97.07 Favored 'General case' 0 C--O 1.212 -0.882 0 C-N-CA 122.685 0.394 . . . . 0.0 111.504 -178.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.62 -49.14 78.9 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 123.16 0.287 . . . . 0.0 111.035 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -56.44 -52.41 64.78 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.899 0.857 . . . . 0.0 109.7 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.487 ' O ' ' HG2' ' A' ' 109' ' ' MET . 8.0 tt -63.54 -40.52 97.21 Favored 'General case' 0 N--CA 1.413 -2.306 0 CA-C-N 113.941 -1.482 . . . . 0.0 110.192 -172.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -61.11 -43.1 99.4 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -68.98 -37.52 78.8 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.002 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.59 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.1 p -66.32 -29.89 48.09 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.265 0 C-N-CA 119.497 -0.881 . . . . 0.0 109.623 177.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.487 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.4 mmt -60.52 -40.11 90.26 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-O 120.646 0.26 . . . . 0.0 110.593 176.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.3 m -60.83 -40.23 92.0 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.936 175.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -75.4 -17.27 60.24 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.808 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 68.4 mt -98.93 -20.61 16.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.994 0.426 . . . . 0.0 110.857 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.41 11.62 47.56 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.642 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -89.18 137.11 32.62 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -177.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -118.21 90.98 3.45 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-O 121.495 0.664 . . . . 0.0 110.258 177.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 75.9 mt -110.95 167.0 10.58 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 28.7 p -100.7 172.54 7.02 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.8 -24.94 67.96 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -67.87 -40.1 83.63 Favored 'General case' 0 N--CA 1.428 -1.547 0 C-N-CA 123.046 0.538 . . . . 0.0 110.784 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -75.49 -42.94 51.6 Favored 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 121.811 -0.556 . . . . 0.0 111.996 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 125' ' ' ILE . 14.1 m -68.39 -29.58 44.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 C-N-CA 120.285 -0.566 . . . . 0.0 109.913 -178.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -70.67 -43.67 68.64 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.324 176.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -64.2 -35.11 79.72 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.469 ' HE3' ' HB1' ' B' ' 84' ' ' ALA . 62.8 mtt -54.15 -51.26 64.85 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.151 175.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.5 mm -69.11 -59.72 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.226 -177.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -61.82 -33.53 74.3 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 -170.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -81.08 -24.39 37.81 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 119.985 -0.686 . . . . 0.0 110.673 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.705 ' HA ' ' SD ' ' A' ' 144' ' ' MET . . . -91.93 -12.85 32.31 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 122.375 1.083 . . . . 0.0 109.768 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -78.82 72.77 5.36 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 122.819 1.295 . . . . 0.0 110.286 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.414 ' HB ' ' OE1' ' A' ' 140' ' ' GLU . 35.7 mt -82.79 -12.26 12.13 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 CA-C-N 114.291 -1.322 . . . . 0.0 107.938 174.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -79.92 -10.42 59.77 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.81 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.64 40.62 99.39 Favored Glycine 0 N--CA 1.442 -0.964 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.744 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -112.34 -16.42 12.95 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.319 0.581 . . . . 0.0 110.142 -177.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 90.99 14.32 57.91 Favored Glycine 0 C--O 1.25 1.147 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 -177.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.539 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 26.0 mt-30 -150.11 139.49 21.4 Favored 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 124.699 1.2 . . . . 0.0 107.791 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.491 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.2 p -76.23 123.99 33.54 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.139 0.495 . . . . 0.0 110.977 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -91.71 154.08 19.22 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.546 ' O ' HG13 ' A' ' 142' ' ' VAL . 82.8 t80 -57.95 -48.99 78.32 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 124.328 1.051 . . . . 0.0 110.151 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -66.71 -22.14 66.07 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.414 ' OE1' ' HB ' ' A' ' 130' ' ' ILE . 29.0 mm-40 -87.32 -37.52 17.06 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -69.21 -35.03 75.78 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.295 -178.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.546 HG13 ' O ' ' A' ' 138' ' ' TYR . 22.2 m -65.19 -31.31 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 121.173 0.511 . . . . 0.0 110.066 177.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -70.83 -48.55 53.43 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.705 ' SD ' ' HA ' ' A' ' 128' ' ' ALA . 82.7 mtp -66.59 -15.82 63.72 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.328 -178.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 57.3 tpp . . . . . 0 C--N 1.312 -1.022 0 CA-C-O 120.818 0.342 . . . . 0.0 110.199 177.397 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . 0.545 ' O ' ' HB2' ' B' ' 86' ' ' LYS . 64.1 tttp . . . . . 0 N--CA 1.452 -0.37 0 CA-C-O 120.62 0.248 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -76.82 -27.64 55.24 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-O 121.104 0.478 . . . . 0.0 110.595 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.469 ' HB1' ' HE3' ' A' ' 124' ' ' MET . . . -62.61 -61.35 2.49 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.582 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.548 ' O ' HG12 ' B' ' 89' ' ' ILE . 57.2 m95 -64.62 -31.05 72.1 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . 0.545 ' HB2' ' O ' ' B' ' 82' ' ' LYS . 78.8 tttt -52.98 -50.02 64.99 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 124.454 1.102 . . . . 0.0 109.866 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -76.38 -41.17 48.92 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.461 177.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' B' ' 85' ' ' TRP . . . -55.13 -59.8 4.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -177.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.548 HG12 ' O ' ' B' ' 85' ' ' TRP . 32.1 pt -68.56 -27.94 38.33 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.707 0 C-N-CA 120.389 -0.524 . . . . 0.0 111.216 -178.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' B' ' 86' ' ' LYS . 8.8 tt0 -62.81 -61.76 2.19 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -65.31 -35.19 80.24 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.285 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.02 -33.24 65.62 Favored 'General case' 0 C--O 1.247 0.926 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 25.0 tptp . . . . . 0 CA--C 1.51 -0.562 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 12' ' ' PHE . 10.2 tp . . . . . 0 N--CA 1.43 -1.425 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 21.2 p -80.81 155.95 26.38 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.816 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -57.45 -44.23 84.61 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -173.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -69.18 -34.05 74.33 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.57 -177.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -63.55 -44.14 95.01 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.495 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 29.6 mt -61.61 -33.25 56.46 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.103 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.541 179.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.13 -46.17 85.3 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-O 121.019 0.437 . . . . 0.0 110.454 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.32 -48.94 75.69 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.406 -0.815 . . . . 0.0 108.986 175.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 56.6 m-85 -71.41 -16.6 62.4 Favored 'General case' 0 C--O 1.187 -2.187 0 CA-C-N 115.324 -0.853 . . . . 0.0 113.148 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 96.0 mttt -69.12 -43.83 73.63 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-O 121.539 0.685 . . . . 0.0 109.279 173.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -71.49 -41.13 69.69 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.644 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.43 -27.96 65.72 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.332 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.435 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 26.2 t80 -64.88 -52.74 54.89 Favored 'General case' 0 C--O 1.198 -1.623 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -71.84 -16.76 62.17 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 123.389 0.431 . . . . 0.0 110.836 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.4 tp -65.72 -36.55 83.93 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 174.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.412 ' CE2' HG21 ' A' ' 35' ' ' VAL . 6.5 m-85 -89.4 -41.86 11.86 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.619 175.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -80.65 81.94 6.78 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-O 122.582 1.182 . . . . 0.0 109.588 176.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -75.96 -19.61 58.6 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 114.287 -1.324 . . . . 0.0 112.861 -173.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.605 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 24.7 m-20 -78.15 -14.46 59.46 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.218 178.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.18 33.37 85.01 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.605 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 6.3 p-10 -112.97 -16.24 12.71 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.939 0.399 . . . . 0.0 110.793 -176.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.28 26.33 14.25 Favored Glycine 0 N--CA 1.441 -1.002 0 N-CA-C 115.635 1.014 . . . . 0.0 115.635 176.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.3 p -141.68 130.53 23.0 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 118.233 1.017 . . . . 0.0 109.096 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 61.2 mt -91.97 115.97 32.12 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.172 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.2 p -96.21 166.78 11.57 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 123.807 0.692 . . . . 0.0 109.944 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 36.4 p -64.27 -27.34 68.97 Favored 'General case' 0 C--O 1.249 1.075 0 CA-C-O 121.216 0.532 . . . . 0.0 110.087 177.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -54.59 -56.85 14.71 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 114.971 -1.013 . . . . 0.0 108.911 174.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.67 -40.13 92.08 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.167 -1.379 . . . . 0.0 111.122 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.421 ' HB3' HD22 ' A' ' 48' ' ' LEU . 91.5 mt -56.53 -60.26 3.8 Favored 'General case' 0 C--O 1.212 -0.898 0 O-C-N 123.58 0.55 . . . . 0.0 110.49 175.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.6 -30.39 72.0 Favored Glycine 0 C--O 1.216 -1.02 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.773 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.6 m -68.98 -49.72 55.38 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.716 0.258 . . . . 0.0 110.915 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.577 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 27.1 m -66.91 -39.18 82.93 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.1 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -58.52 -45.48 88.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.532 0.52 . . . . 0.0 110.261 175.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -62.83 -35.41 79.84 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 123.255 0.622 . . . . 0.0 109.951 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 m -76.34 -12.93 60.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.814 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 97.4 mt -96.9 -17.68 19.99 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.169 177.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.8 32.11 9.47 Favored Glycine 0 C--N 1.311 -0.818 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.426 ' C ' HD22 ' A' ' 42' ' ' ASN . 63.7 tt0 -129.49 133.34 47.23 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.426 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -129.94 81.64 68.49 Favored Pre-proline 0 C--N 1.305 -1.363 0 O-C-N 121.034 -1.041 . . . . 0.0 113.596 -178.07 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -78.68 155.56 27.47 Favored 'Trans proline' 0 C--O 1.247 0.951 0 C-N-CA 122.13 1.887 . . . . 0.0 109.994 171.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.459 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 70.4 p -84.1 167.21 17.0 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.793 0.33 . . . . 0.0 111.757 -177.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -55.78 -45.73 78.09 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.506 1.122 . . . . 0.0 112.077 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.79 -41.98 92.38 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 120.766 0.317 . . . . 0.0 110.942 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -63.92 -48.33 77.02 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.476 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 44' ' ' THR . 91.1 mt -59.0 -42.65 90.59 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.231 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -69.78 -41.84 74.59 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -66.33 -35.92 81.6 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.436 0.636 . . . . 0.0 109.765 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.43 ' HB3' ' O ' ' A' ' 48' ' ' LEU . 38.7 ttm -57.35 -39.97 77.05 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.593 1.557 . . . . 0.0 110.159 177.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 59.3 mt -74.27 -49.6 31.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.499 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.17 -31.0 62.99 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.383 -0.826 . . . . 0.0 113.02 -172.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -70.64 -11.36 60.89 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.504 HG11 ' SD ' ' A' ' 71' ' ' MET . 28.4 m -119.89 -18.19 6.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 O-C-N 122.403 -0.186 . . . . 0.0 110.863 174.085 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -70.13 107.72 3.8 Favored 'General case' 0 N--CA 1.444 -0.772 0 O-C-N 123.777 0.673 . . . . 0.0 111.076 -176.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.86 -9.86 54.77 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.602 -176.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.58 -11.63 20.82 Favored 'General case' 0 CA--C 1.493 -1.244 0 C-N-CA 119.964 -0.694 . . . . 0.0 110.503 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.63 41.95 99.07 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 -174.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.9 p-10 -114.3 -11.23 12.6 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.187 0.518 . . . . 0.0 110.867 -176.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.29 15.6 55.22 Favored Glycine 0 N--CA 1.431 -1.635 0 C-N-CA 120.82 -0.705 . . . . 0.0 114.418 173.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 11.9 p -137.52 147.11 44.93 Favored 'General case' 0 C--O 1.248 1.022 0 CA-C-N 117.812 0.806 . . . . 0.0 111.628 177.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.567 HG21 ' HE2' ' A' ' 71' ' ' MET . 15.6 mt -99.68 110.53 27.05 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -84.58 -179.55 7.17 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.421 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 44.7 t80 -58.76 -53.93 61.36 Favored Pre-proline 0 C--N 1.311 -1.098 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -175.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.2 Cg_endo -52.98 -41.91 68.1 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.901 2.401 . . . . 0.0 111.757 176.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -67.25 -44.74 78.67 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.022 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.582 ' O ' ' HG2' ' A' ' 72' ' ' MET . 86.6 t80 -60.12 -41.82 93.45 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.049 0.539 . . . . 0.0 109.846 177.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.415 HD11 ' CE2' ' A' ' 65' ' ' PHE . 92.9 mt -65.09 -55.55 18.11 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.353 177.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 94.8 m -55.94 -41.43 74.63 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.417 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.567 ' HE2' HG21 ' A' ' 63' ' ' ILE . 20.0 ttp -55.65 -47.03 77.33 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.629 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.582 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 10.5 mmt -71.73 -41.31 68.66 Favored 'General case' 0 CA--C 1.486 -1.494 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.769 -176.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.5 -27.89 69.28 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.542 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -83.55 -30.59 26.94 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.453 0.644 . . . . 0.0 110.776 175.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -85.31 -3.29 58.78 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.895 0.855 . . . . 0.0 110.272 -173.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.522 ' HG3' ' O ' ' A' ' 72' ' ' MET . 61.7 mtt . . . . . 0 N--CA 1.429 -1.475 0 CA-C-O 121.947 0.88 . . . . 0.0 110.053 175.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 . . . . . 0 N--CA 1.442 -0.862 0 CA-C-O 121.069 0.462 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -63.84 -33.52 75.88 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.938 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 34.3 tt0 -65.3 -31.1 72.07 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 122.106 0.955 . . . . 0.0 109.494 178.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.7 mm -81.42 -29.09 10.57 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 -175.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -78.73 -26.25 44.68 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.617 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.456 ' HB3' ' O ' ' A' ' 84' ' ' GLU . 41.2 tt0 -62.67 -54.87 32.88 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 172.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.45 -39.74 76.95 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 113.741 -1.572 . . . . 0.0 110.617 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -62.49 -46.32 88.97 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.49 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 78.5 mtm180 -68.02 -25.09 65.21 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -178.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.416 HG11 ' HB1' ' B' ' 92' ' ' ALA . 14.0 p -82.79 -19.72 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 120.196 -0.601 . . . . 0.0 110.633 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -91.84 -56.84 2.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -84.98 83.99 7.87 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 122.09 0.948 . . . . 0.0 109.155 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -78.84 -35.17 44.37 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.642 -177.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -72.16 -14.32 61.79 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.516 0.674 . . . . 0.0 110.581 -178.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.62 54.09 10.95 Favored Glycine 0 N--CA 1.431 -1.685 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.288 175.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -89.21 -18.56 26.85 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 121.02 0.438 . . . . 0.0 110.13 176.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.18 13.0 75.17 Favored Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -178.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.434 ' HB3' ' HG2' ' A' ' 135' ' ' GLN . 76.4 m-85 -149.7 143.21 25.32 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.552 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.8 mt -87.84 109.68 19.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.8 m -80.18 140.04 36.51 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.42 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -59.47 -39.45 83.75 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 122.48 0.312 . . . . 0.0 111.416 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.81 -50.18 74.49 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.303 0.377 . . . . 0.0 111.497 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -70.51 -38.21 74.25 Favored 'General case' 0 CA--C 1.506 -0.749 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.787 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.484 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.5 tm? -59.58 -43.89 93.5 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.497 ' HA ' HG11 ' A' ' 121' ' ' VAL . 39.2 ttt180 -61.62 -45.13 95.4 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.536 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.5 m170 -59.87 -49.4 77.85 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.671 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.583 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -64.88 -33.36 63.03 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.385 0 C-N-CA 120.134 -0.626 . . . . 0.0 110.573 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.484 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.1 mmt -61.23 -41.94 97.75 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 120.887 0.375 . . . . 0.0 111.534 179.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 61.3 m -61.0 -38.51 86.29 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.217 176.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -76.73 -22.59 53.64 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.073 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 95.1 mt -88.95 -19.71 25.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.201 0.524 . . . . 0.0 110.541 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.36 0.55 55.71 Favored Glycine 0 N--CA 1.436 -1.336 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.162 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -70.62 -38.15 73.9 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.8 mttm 59.24 33.27 22.55 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.32 174.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.438 HD22 ' HG2' ' A' ' 120' ' ' GLU . 60.2 mt -64.52 138.25 58.3 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.621 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 36.8 p -76.91 174.42 10.6 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.857 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -63.35 -44.32 95.15 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 116.9 -0.136 . . . . 0.0 111.263 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.506 ' CD ' ' H ' ' A' ' 119' ' ' GLU . 1.4 mp0 -59.52 -37.6 78.76 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.438 ' HG2' HD22 ' A' ' 116' ' ' LEU . 8.1 tp10 -66.78 -55.77 13.45 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.464 -178.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.499 ' O ' HG12 ' A' ' 125' ' ' ILE . 11.4 m -64.21 -32.55 57.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.032 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -60.88 -45.74 93.39 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.688 0.795 . . . . 0.0 110.295 175.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -65.18 -43.32 92.06 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.184 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 54.1 mtt -56.54 -37.27 70.27 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.301 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.9 mm -76.22 -58.27 4.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -50.97 -44.83 60.76 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.935 1.294 . . . . 0.0 113.957 -173.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -83.54 -13.61 54.11 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 119.65 -0.82 . . . . 0.0 111.081 -174.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -96.76 -22.3 17.04 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.505 0.669 . . . . 0.0 109.582 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -72.7 92.53 1.56 Allowed 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.546 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.412 ' HB ' ' HG3' ' A' ' 140' ' ' GLU . 57.0 mt -82.41 -19.59 10.4 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.668 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.841 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -89.22 -12.06 41.88 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-O 121.408 0.623 . . . . 0.0 110.866 -173.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.09 36.7 60.36 Favored Glycine 0 N--CA 1.429 -1.771 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.2 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -95.3 -16.6 22.3 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.393 0.616 . . . . 0.0 109.438 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.29 13.19 82.22 Favored Glycine 0 CA--C 1.503 -0.705 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -175.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.434 ' HG2' ' HB3' ' A' ' 99' ' ' TYR . 9.4 tt0 -151.09 144.73 25.01 Favored 'General case' 0 N--CA 1.418 -2.061 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 -176.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.552 HG13 ' HB ' ' A' ' 100' ' ' ILE . 2.4 p -97.27 112.21 28.8 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.99 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -172.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.45 ' HB3' ' OE2' ' A' ' 140' ' ' GLU . 45.1 t30 -76.38 162.62 27.72 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.825 178.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -56.21 -48.3 76.69 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 123.431 0.693 . . . . 0.0 112.374 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.533 ' HA ' HG22 ' A' ' 142' ' ' VAL . 41.3 mt-10 -66.65 -41.13 88.74 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.262 0.553 . . . . 0.0 111.422 -178.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.45 ' OE2' ' HB3' ' A' ' 137' ' ' ASN . 2.8 mp0 -56.78 -45.71 81.98 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.767 174.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -64.73 -50.84 65.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.843 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.533 HG22 ' HA ' ' A' ' 139' ' ' GLU . 24.2 m -62.43 -37.97 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -176.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -51.68 -59.51 4.21 Favored 'General case' 0 C--O 1.233 0.237 0 O-C-N 123.986 0.804 . . . . 0.0 110.482 -177.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.72 -26.68 44.81 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -172.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 2.6 tmm? . . . . . 0 C--N 1.318 -0.802 0 C-N-CA 120.275 -0.57 . . . . 0.0 110.959 -174.101 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt . . . . . 0 C--O 1.211 -0.944 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -69.55 -31.59 69.88 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.432 0.634 . . . . 0.0 109.334 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.462 ' HA ' ' CE1' ' B' ' 87' ' ' HIS . . . -61.98 -54.92 35.04 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.14 173.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 26.9 m95 -57.68 -40.96 80.61 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.341 175.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -54.72 -58.26 8.26 Favored 'General case' 0 CA--C 1.501 -0.934 0 C-N-CA 123.45 0.7 . . . . 0.0 110.169 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . 0.462 ' CE1' ' HA ' ' B' ' 84' ' ' ALA . 2.8 p-80 -65.49 -30.85 71.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.243 -0.583 . . . . 0.0 112.465 -179.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.08 -47.67 73.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.301 0.572 . . . . 0.0 110.061 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 85.4 mt -66.47 -36.66 77.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.73 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -59.01 -45.36 90.88 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.407 ' CG ' ' HB3' ' A' ' 112' ' ' LEU . 4.0 tppp? -64.55 -43.87 92.59 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.271 175.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . 0.416 ' HB1' HG11 ' A' ' 91' ' ' VAL . . . -61.18 -33.72 73.9 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.318 0.58 . . . . 0.0 110.983 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 22.6 mtpp . . . . . 0 C--N 1.316 -0.873 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.857 176.508 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.468 HD23 HD22 ' A' ' 69' ' ' LEU . 12.0 tp . . . . . 0 N--CA 1.425 -1.695 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.9 p -82.59 152.94 25.72 Favored 'General case' 0 N--CA 1.428 -1.564 0 O-C-N 123.364 0.415 . . . . 0.0 110.9 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -53.53 -45.19 69.68 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -171.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.55 -37.91 88.09 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-O 120.733 0.301 . . . . 0.0 110.992 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.426 ' HB3' ' HE1' ' A' ' 76' ' ' MET . 5.8 mm-40 -72.76 -33.09 66.11 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.507 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 36.3 mt -66.08 -34.45 70.34 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.095 176.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.5 -37.78 80.39 Favored 'General case' 0 C--O 1.252 1.21 0 CA-C-O 121.815 0.817 . . . . 0.0 109.88 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -62.75 -40.08 96.13 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.155 176.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -79.75 -16.36 55.74 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 30.5 mmtp -61.92 -47.2 85.98 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 171.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -59.78 -52.95 63.26 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 114.285 -1.325 . . . . 0.0 110.327 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.94 82.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.76 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -65.78 -45.91 80.71 Favored 'General case' 0 C--O 1.206 -1.232 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.601 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 32.1 t -69.25 -23.74 63.9 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 120.732 0.301 . . . . 0.0 111.047 -177.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.292 1.0 OUTLIER -62.1 -57.03 13.09 Favored 'General case' 0 CA--C 1.476 -1.866 0 CA-C-O 123.196 1.474 . . . . 0.0 107.091 174.268 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.493 ' CZ ' HD23 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -74.43 -33.89 63.07 Favored 'General case' 1 N--CA 1.368 -4.564 0 CA-C-N 111.666 -2.515 . . . . 0.0 109.605 -167.72 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -78.19 84.38 4.41 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-O 122.235 1.017 . . . . 0.0 108.416 173.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.7 mmtm -67.75 -32.23 72.68 Favored 'General case' 0 N--CA 1.421 -1.908 0 CA-C-N 113.931 -1.486 . . . . 0.0 112.439 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -87.34 -13.48 43.44 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.919 -176.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.96 50.57 64.33 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 -177.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -113.4 -12.11 13.03 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -176.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.88 5.8 57.34 Favored Glycine 0 C--N 1.306 -1.128 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.309 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.8 p -143.04 145.62 33.07 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 117.758 0.779 . . . . 0.0 111.838 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.8 mt -95.46 118.02 40.74 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 69.6 p -100.79 169.5 8.96 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.139 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 77.8 p -63.31 -30.95 71.99 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 121.255 0.55 . . . . 0.0 109.995 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.1 tttm -50.04 -55.97 12.66 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.759 1.223 . . . . 0.0 109.348 175.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -67.65 -40.07 84.57 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.626 -176.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.493 HD23 ' CZ ' ' A' ' 19' ' ' PHE . 83.9 mt -54.17 -55.85 23.88 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.978 0.894 . . . . 0.0 109.498 177.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.76 -21.38 73.01 Favored Glycine 0 C--O 1.215 -1.093 0 CA-C-N 115.4 -0.818 . . . . 0.0 113.288 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.7 m -74.32 -48.27 29.32 Favored 'General case' 0 C--O 1.254 1.293 0 CA-C-N 117.497 0.648 . . . . 0.0 110.376 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 m -68.64 -32.81 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.463 ' HB3' ' HB3' ' A' ' 41' ' ' GLN . 41.1 mtm -73.26 -27.71 61.73 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -61.24 -39.69 91.25 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.0 m -63.46 -27.55 69.36 Favored 'General case' 0 CA--C 1.554 1.129 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.457 176.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.412 HD12 ' HB2' ' A' ' 41' ' ' GLN . 2.4 tm? -88.88 -23.64 22.71 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.194 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 103.74 11.99 31.4 Favored Glycine 0 C--N 1.308 -1.026 0 C-N-CA 120.189 -1.005 . . . . 0.0 112.39 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.463 ' HB3' ' HB3' ' A' ' 36' ' ' MET . 2.4 tp-100 -101.28 125.01 47.86 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 179.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.413 HD22 ' C ' ' A' ' 41' ' ' GLN . 1.0 OUTLIER -125.87 75.26 71.2 Favored Pre-proline 0 C--N 1.294 -1.825 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.061 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.432 ' HG2' HD21 ' A' ' 48' ' ' LEU . 5.6 Cg_exo -77.64 147.91 25.39 Favored 'Trans proline' 0 N--CA 1.448 -1.164 0 C-N-CA 121.777 1.651 . . . . 0.0 109.977 176.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.5 p -68.56 154.02 42.66 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-O 120.533 0.206 . . . . 0.0 110.845 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -59.48 -30.57 68.63 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 122.801 0.44 . . . . 0.0 110.982 -177.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.27 78.54 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.338 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 51' ' ' MET . 55.2 mm-40 -65.97 -43.34 88.14 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.98 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.432 HD21 ' HG2' ' A' ' 43' ' ' PRO . 85.6 mt -67.43 -34.15 76.62 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.327 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.41 -44.77 90.19 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 178.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.56 -41.22 98.42 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.35 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 67.5 mtt -61.84 -42.53 99.14 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.084 178.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.9 mt -63.36 -45.07 99.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.998 0.428 . . . . 0.0 110.584 176.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -58.59 -18.28 28.8 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -175.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -64.82 -41.49 95.72 Favored 'General case' 0 N--CA 1.39 -3.472 0 O-C-N 121.783 -0.573 . . . . 0.0 110.051 177.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.582 HG11 ' SD ' ' A' ' 71' ' ' MET . 17.1 m -104.74 -17.33 7.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.429 -178.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -67.89 113.43 5.61 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -178.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.7 -23.73 36.61 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.229 0.537 . . . . 0.0 110.612 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -99.01 -11.89 21.1 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.399 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.52 51.55 57.12 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.642 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -115.22 -4.19 12.46 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 120.84 0.353 . . . . 0.0 111.906 -176.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.56 13.66 37.4 Favored Glycine 0 N--CA 1.438 -1.22 0 C-N-CA 120.829 -0.701 . . . . 0.0 113.299 174.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 11.2 p -141.48 139.55 33.35 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.882 0.341 . . . . 0.0 110.564 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 mt -91.47 113.25 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.941 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -83.85 166.19 18.13 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.463 ' CE2' HD11 ' A' ' 69' ' ' LEU . 56.5 t80 -56.79 -57.69 22.36 Favored Pre-proline 0 CA--C 1.555 1.145 0 O-C-N 123.568 0.543 . . . . 0.0 112.213 -177.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.17 -39.51 90.62 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.496 2.131 . . . . 0.0 112.539 177.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -63.4 -44.97 93.15 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.332 0.586 . . . . 0.0 110.287 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.63 -26.32 57.66 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.665 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.468 HD22 HD23 ' A' ' 4' ' ' LEU . 80.4 mt -63.98 -42.1 97.33 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 174.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.41 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 47.2 m -56.4 -48.69 76.4 Favored 'General case' 0 C--O 1.239 0.544 0 O-C-N 123.835 0.709 . . . . 0.0 109.152 175.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.582 ' SD ' HG11 ' A' ' 55' ' ' VAL . 40.4 ttp -54.65 -55.4 30.0 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.841 177.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 20.7 mmt -62.33 -38.62 90.16 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.4 -19.31 63.81 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 70' ' ' THR . 95.0 mtt180 -84.11 -29.86 26.42 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.23 0.538 . . . . 0.0 110.507 173.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -83.68 -33.74 25.12 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.803 0.811 . . . . 0.0 109.996 -176.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.426 ' HE1' ' HB3' ' A' ' 8' ' ' GLN . 34.9 ttm . . . . . 0 C--N 1.303 -1.454 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.842 -176.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 121.838 0.828 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.48 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -60.34 -45.43 93.48 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.312 -1.313 . . . . 0.0 112.331 -175.715 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -59.52 -42.69 92.84 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 121.776 0.798 . . . . 0.0 110.356 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.461 HG21 HG12 ' A' ' 142' ' ' VAL . 8.0 mm -70.6 -42.87 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 CA-C-N 114.113 -1.403 . . . . 0.0 108.929 -173.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -71.16 -38.08 72.2 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.682 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.507 ' HB2' ' HE2' ' B' ' 93' ' ' LYS . 52.5 mt-10 -58.62 -46.82 86.24 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 175.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.76 -40.1 91.71 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.094 -179.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -65.44 -49.33 69.54 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.16 0.505 . . . . 0.0 109.966 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 24.5 ttp85 -58.35 -38.79 77.9 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.375 1.07 . . . . 0.0 112.432 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 9.6 p -75.97 -19.57 15.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.643 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -86.69 -50.81 6.52 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.453 174.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -95.59 76.46 3.28 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.947 0.879 . . . . 0.0 110.994 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -79.06 -29.4 43.44 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.542 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.99 -12.98 61.49 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.241 0.543 . . . . 0.0 111.457 -178.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.56 48.47 10.5 Favored Glycine 0 N--CA 1.435 -1.407 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.743 176.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -80.92 -19.91 43.24 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.23 -0.38 85.66 Favored Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 110.759 -0.937 . . . . 0.0 110.759 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.1 p90 -156.74 158.24 36.54 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -178.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.576 ' HB ' HG13 ' A' ' 136' ' ' VAL . 1.7 mt -87.41 106.09 15.84 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.3 t -93.82 143.71 26.09 Favored 'General case' 0 N--CA 1.422 -1.825 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.499 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.56 -38.99 92.93 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 123.218 0.607 . . . . 0.0 111.45 -177.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.7 -46.21 89.76 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.394 0.616 . . . . 0.0 109.981 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.581 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 2.8 tp10 -66.71 -45.64 78.08 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.392 176.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.99 -35.99 78.28 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -175.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.498 ' HB2' HG21 ' A' ' 121' ' ' VAL . 29.5 ttp180 -64.96 -36.2 83.63 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.296 177.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.581 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 42.9 m170 -56.72 -50.97 70.6 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.124 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.697 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.1 p -70.72 -33.06 51.31 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.838 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.36 -177.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 20.9 mmt -62.3 -46.72 87.48 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.3 m -65.23 -30.88 71.81 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.374 0.607 . . . . 0.0 109.498 177.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -71.89 -32.32 67.31 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.462 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 71.9 mt -85.47 -19.38 31.33 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 121.024 0.44 . . . . 0.0 110.69 -176.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.54 14.15 57.35 Favored Glycine 0 N--CA 1.434 -1.435 0 C-N-CA 120.56 -0.828 . . . . 0.0 111.606 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.428 ' OE1' ' HG3' ' B' ' 91' ' ' LYS . 30.9 mm-40 -74.48 -36.85 63.3 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 55.94 62.23 2.47 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 122.421 1.105 . . . . 0.0 110.78 178.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 71.2 mt -92.81 147.13 23.11 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.2 p -77.84 174.43 11.03 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 120.354 -0.538 . . . . 0.0 110.462 -179.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -68.37 -38.05 81.01 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.149 0.499 . . . . 0.0 109.705 -178.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 119' ' ' GLU . 1.4 mp0 -63.45 -42.49 98.64 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 177.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -61.99 -54.85 35.96 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.437 1.095 . . . . 0.0 110.53 -177.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.498 HG21 ' HB2' ' A' ' 106' ' ' ARG . 25.3 m -63.39 -36.98 78.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.002 -177.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -72.18 -32.35 66.75 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.699 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -64.2 -47.58 79.21 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 mtt -51.68 -50.47 60.36 Favored 'General case' 0 CA--C 1.503 -0.844 0 O-C-N 123.601 0.563 . . . . 0.0 110.381 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.532 ' CG2' ' HA ' ' A' ' 135' ' ' GLN . 40.4 mm -60.11 -49.46 83.99 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.538 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.143 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.4 ttm180 -65.64 -30.82 71.58 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 123.298 0.639 . . . . 0.0 111.474 -175.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -78.03 -34.03 50.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.842 0.353 . . . . 0.0 110.683 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.13 -28.12 42.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.648 0.737 . . . . 0.0 109.282 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -74.84 94.4 2.77 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.681 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.433 ' HB ' ' HG3' ' A' ' 140' ' ' GLU . 9.6 mt -82.19 -19.06 10.81 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.804 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.151 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -82.62 -11.5 58.34 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.591 -173.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.3 24.06 72.06 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.177 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -87.11 -17.08 33.65 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.44 0.638 . . . . 0.0 109.768 -177.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 97.01 -18.62 57.2 Favored Glycine 0 N--CA 1.437 -1.277 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.192 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.532 ' HA ' ' CG2' ' A' ' 125' ' ' ILE . 31.8 mt-30 -134.44 147.33 50.41 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.576 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.7 p -94.76 124.03 47.1 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -173.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -93.4 175.4 6.77 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.547 ' O ' HG13 ' A' ' 142' ' ' VAL . 73.5 t80 -60.19 -45.69 92.26 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -175.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.638 ' O ' HG22 ' A' ' 142' ' ' VAL . 35.6 mm-40 -61.59 -43.58 98.6 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.331 0.586 . . . . 0.0 111.644 -179.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.433 ' HG3' ' HB ' ' A' ' 130' ' ' ILE . 0.3 OUTLIER -68.14 -33.79 75.14 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.041 178.546 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -67.72 -38.97 84.3 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.998 176.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.638 HG22 ' O ' ' A' ' 139' ' ' GLU . 7.2 m -59.05 -38.53 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.46 -178.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -76.37 -41.46 48.01 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.617 -175.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 3.7 ppp? -76.52 -32.2 58.13 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.155 -0.618 . . . . 0.0 112.101 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.5 tpt . . . . . 0 C--N 1.322 -0.59 0 CA-C-O 121.114 0.483 . . . . 0.0 110.571 179.606 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp . . . . . 0 N--CA 1.418 -2.04 0 CA-C-O 120.404 0.145 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -58.92 -55.49 34.42 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.481 1.134 . . . . 0.0 108.675 176.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.03 -50.99 60.33 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 112.613 -2.085 . . . . 0.0 112.263 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -72.6 -28.6 62.88 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -58.84 -55.93 28.77 Favored 'General case' 0 CA--C 1.481 -1.693 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 172.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -46.66 -58.33 3.94 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 125.113 1.508 . . . . 0.0 111.333 175.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.12 -52.85 62.85 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 45.4 mm -65.14 -49.01 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-O 120.99 0.424 . . . . 0.0 110.102 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -60.92 -37.35 81.98 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.968 0.907 . . . . 0.0 112.047 -176.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.428 ' HG3' ' OE1' ' A' ' 114' ' ' GLU . 14.0 mmmm -81.73 -42.18 20.2 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.95 -51.26 10.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.074 0.464 . . . . 0.0 111.588 -177.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.507 ' HE2' ' HB2' ' A' ' 87' ' ' GLU . 58.2 tttm . . . . . 0 C--N 1.32 -0.701 0 CA-C-O 122.356 1.074 . . . . 0.0 110.321 -175.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.428 ' HB3' HD11 ' A' ' 9' ' ' ILE . 11.1 tp . . . . . 0 N--CA 1.437 -1.104 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.5 p -82.65 153.76 25.24 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.255 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -53.62 -44.05 69.18 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 125.018 1.327 . . . . 0.0 110.959 -176.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -55.89 -49.01 74.6 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.107 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -68.57 -47.22 67.36 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.722 -178.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.622 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 60.3 mt -57.37 -40.24 73.02 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.464 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.329 -178.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.31 -49.03 79.38 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-O 120.792 0.33 . . . . 0.0 111.4 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -60.2 -41.18 92.43 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.637 0.732 . . . . 0.0 109.578 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.494 ' CE2' ' HG2' ' A' ' 72' ' ' MET . 36.5 m-85 -77.27 -13.62 59.9 Favored 'General case' 0 C--O 1.207 -1.156 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.622 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 97.7 mttt -69.64 -43.41 72.67 Favored 'General case' 0 C--O 1.249 1.059 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 173.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -64.64 -45.45 86.76 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.014 -0.993 . . . . 0.0 110.18 176.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.454 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -58.52 -47.88 82.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.356 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -57.03 -49.15 76.7 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.336 0.655 . . . . 0.0 111.196 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.3 m -76.99 -19.61 57.08 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.234 -174.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 15' ' ' ALA . 4.5 pp -79.21 -21.98 45.52 Favored 'General case' 0 CA--C 1.502 -0.9 0 C-N-CA 118.979 -1.088 . . . . 0.0 110.741 176.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.462 ' CE2' ' HA ' ' A' ' 32' ' ' LEU . 2.7 t80 -80.7 -50.85 9.37 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.46 79.72 3.17 Favored 'General case' 0 N--CA 1.416 -2.145 0 CA-C-N 113.012 -1.904 . . . . 0.0 110.47 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -54.58 -34.39 61.85 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 113.584 -1.644 . . . . 0.0 112.793 -175.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -92.87 -8.18 44.12 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.734 -170.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.5 37.12 94.02 Favored Glycine 0 C--O 1.235 0.208 0 C-N-CA 121.344 -0.455 . . . . 0.0 112.626 177.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -100.87 -16.2 17.32 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 122.755 -0.262 . . . . 0.0 111.288 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.5 6.96 76.59 Favored Glycine 0 N--CA 1.439 -1.126 0 C-N-CA 120.554 -0.831 . . . . 0.0 114.4 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.8 p -128.68 130.69 47.53 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 118.063 0.931 . . . . 0.0 109.737 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 51.2 mt -96.15 122.01 47.24 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.492 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.4 p -101.86 168.32 9.5 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.037 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.426 HG23 HD12 ' A' ' 52' ' ' ILE . 32.4 p -64.84 -27.74 69.08 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.131 0.491 . . . . 0.0 110.496 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -57.47 -57.16 13.87 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 177.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.49 -37.9 89.16 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 114.543 -1.208 . . . . 0.0 111.834 -176.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 28' ' ' THR . 96.4 mt -52.85 -62.84 1.39 Allowed 'General case' 0 CA--C 1.501 -0.932 0 O-C-N 124.237 0.961 . . . . 0.0 109.85 178.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.07 -28.52 71.56 Favored Glycine 0 N--CA 1.428 -1.861 0 C-N-CA 119.875 -1.155 . . . . 0.0 113.268 -176.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.3 m -60.82 -55.36 34.01 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 118.105 0.953 . . . . 0.0 111.007 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.69 -35.05 30.12 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.746 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.3 mtp -64.98 -37.29 87.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.419 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -64.85 -40.77 95.68 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 122.703 0.401 . . . . 0.0 110.027 176.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.4 m -65.4 -26.82 68.16 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.371 0.605 . . . . 0.0 110.339 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.423 ' HB3' ' HE3' ' B' ' 91' ' ' LYS . 4.6 mm? -94.72 8.98 40.68 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.785 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.447 ' HA3' ' HA3' ' A' ' 113' ' ' GLY . . . 87.03 35.54 9.72 Favored Glycine 0 C--N 1.312 -0.786 0 C-N-CA 120.032 -1.08 . . . . 0.0 115.719 172.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -143.16 121.78 12.53 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 172.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.442 HD22 ' N ' ' A' ' 42' ' ' ASN . 0.7 OUTLIER -116.06 84.49 13.71 Favored Pre-proline 0 C--N 1.309 -1.183 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.723 -178.884 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.657 ' HG2' HD21 ' A' ' 48' ' ' LEU . 19.1 Cg_endo -84.47 169.22 11.07 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.386 2.058 . . . . 0.0 111.655 176.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.0 p -96.48 170.3 9.31 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.848 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -56.49 -42.48 78.36 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.55 1.14 . . . . 0.0 110.368 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.24 -47.77 84.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.364 -178.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -63.73 -43.69 95.74 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.361 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.657 HD21 ' HG2' ' A' ' 43' ' ' PRO . 94.1 mt -62.7 -34.09 76.42 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.709 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -72.58 -34.39 67.42 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.69 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -65.68 -42.26 91.46 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.2 mtt -55.28 -42.84 74.1 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.655 177.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.426 HD12 HG23 ' A' ' 29' ' ' THR . 33.3 mt -71.16 -56.52 10.27 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.612 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.815 176.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -54.22 -31.04 52.15 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -174.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.94 -42.5 89.96 Favored 'General case' 0 N--CA 1.415 -2.19 0 C-N-CA 124.009 0.924 . . . . 0.0 110.744 175.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.55 HG11 ' SD ' ' A' ' 71' ' ' MET . 9.5 m -102.84 -18.9 6.37 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.194 -175.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -68.63 109.7 3.9 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.56 -40.33 21.06 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.041 -173.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -94.44 -9.91 34.07 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.143 -176.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.88 53.24 31.83 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.977 177.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.2 p-10 -107.6 -9.71 15.82 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 120.65 -0.42 . . . . 0.0 111.241 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 106.95 -0.05 35.94 Favored Glycine 0 N--CA 1.439 -1.159 0 C-N-CA 120.386 -0.911 . . . . 0.0 113.306 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.5 p -135.27 151.33 50.47 Favored 'General case' 0 C--O 1.249 1.068 0 CA-C-N 117.609 0.705 . . . . 0.0 111.888 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.1 mt -93.71 110.34 23.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 175.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -82.49 175.11 10.47 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 177.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.448 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 59.8 t80 -61.08 -52.9 68.56 Favored Pre-proline 0 C--N 1.302 -1.487 0 CA-C-O 119.255 -0.403 . . . . 0.0 111.484 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -53.02 -34.94 69.89 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.769 2.313 . . . . 0.0 112.522 174.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -74.39 -39.87 62.4 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -61.85 -42.54 99.17 Favored 'General case' 0 C--O 1.246 0.889 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 76.3 mt -60.47 -46.55 89.66 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.022 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.2 m -57.89 -42.22 84.18 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 123.52 0.512 . . . . 0.0 110.853 177.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.55 ' SD ' HG11 ' A' ' 55' ' ' VAL . 30.6 ttp -57.79 -45.92 85.35 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 121.021 0.439 . . . . 0.0 111.451 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.494 ' HG2' ' CE2' ' A' ' 12' ' ' PHE . 34.6 tpp -76.3 -33.74 59.06 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.222 -176.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.35 -21.73 62.0 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.745 -179.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -83.64 -27.49 29.09 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 121.549 0.69 . . . . 0.0 109.663 173.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -86.39 -38.66 17.17 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.302 -173.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.411 ' HG2' ' OE1' ' A' ' 84' ' ' GLU . 32.5 mtm . . . . . 0 CA--C 1.507 -0.684 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.99 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -60.46 -62.73 1.65 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.411 ' OE1' ' HG2' ' A' ' 76' ' ' MET . 45.3 mt-10 -67.04 -35.09 79.12 Favored 'General case' 0 CA--C 1.485 -1.539 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.315 -178.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.407 ' CG2' HG12 ' A' ' 142' ' ' VAL . 26.8 mm -61.13 -46.02 97.44 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.408 -176.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.1 ttp-105 -67.97 -50.16 57.37 Favored 'General case' 0 C--O 1.196 -1.745 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.032 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -55.49 -39.2 70.12 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.5 86.81 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 120.501 0.191 . . . . 0.0 111.132 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -71.57 -49.15 43.28 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -56.59 -32.5 65.29 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 126.521 1.929 . . . . 0.0 112.485 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.52 -28.63 16.11 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 C-N-CA 120.197 -0.601 . . . . 0.0 111.304 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -81.6 -47.64 12.78 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 174.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -83.84 61.74 6.55 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 122.974 1.369 . . . . 0.0 107.452 175.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -77.84 -24.03 48.76 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.415 -172.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -93.49 -13.34 27.97 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.497 0.665 . . . . 0.0 110.359 -177.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.2 62.85 1.46 Allowed Glycine 0 N--CA 1.435 -1.372 0 C-N-CA 120.494 -0.86 . . . . 0.0 111.589 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -106.02 -19.26 13.78 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-O 121.587 0.708 . . . . 0.0 109.246 177.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.08 -13.38 59.73 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.672 175.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.412 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 83.4 m-85 -139.7 132.32 28.84 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -176.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.57 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.7 mt -80.37 121.82 34.48 Favored 'Isoleucine or valine' 0 C--O 1.252 1.225 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.4 m -101.19 161.73 13.4 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 123.349 0.406 . . . . 0.0 109.978 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.12 -52.89 20.1 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -172.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.33 -29.98 69.68 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 121.73 0.776 . . . . 0.0 109.226 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.18 -39.85 93.44 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.307 -1.315 . . . . 0.0 110.499 175.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.512 HD22 HG12 ' A' ' 121' ' ' VAL . 4.9 tt -64.85 -45.79 84.61 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 177.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.511 ' HG3' HG11 ' A' ' 121' ' ' VAL . 51.0 mtp180 -61.35 -35.67 78.06 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.919 -0.488 . . . . 0.0 111.67 175.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -61.37 -51.56 68.29 Favored 'General case' 0 C--O 1.259 1.587 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.818 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.63 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 10.5 p -65.59 -35.41 75.17 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.635 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.911 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.458 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.0 mmt -60.75 -40.18 91.5 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 56.8 m -59.87 -40.9 90.22 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 176.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -72.96 -26.82 61.51 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.491 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 81.8 mt -86.56 -7.45 58.36 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.166 0.507 . . . . 0.0 109.901 -178.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . 0.447 ' HA3' ' HA3' ' A' ' 40' ' ' GLY . . . 70.37 13.6 70.91 Favored Glycine 0 N--CA 1.432 -1.586 0 CA-C-N 115.085 -0.961 . . . . 0.0 113.168 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -86.84 -35.4 19.08 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp 57.15 94.78 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.307 1.043 . . . . 0.0 111.954 176.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 72.0 mt -110.91 155.86 22.03 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 120.894 0.378 . . . . 0.0 111.292 -176.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.0 p -85.37 161.12 19.6 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.607 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -64.26 -41.14 97.08 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -69.06 -33.36 73.45 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.646 0.736 . . . . 0.0 110.307 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -68.15 -51.59 44.19 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.583 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.512 HG12 HD22 ' A' ' 105' ' ' LEU . 16.7 m -67.79 -30.57 48.9 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.429 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.325 178.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.93 -44.01 90.89 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.299 178.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.97 -43.67 98.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 65.4 mtt -56.65 -55.0 39.58 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 124.01 0.819 . . . . 0.0 111.038 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.2 mm -58.11 -55.37 22.52 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.416 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.724 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 -58.14 -43.15 87.17 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 113.186 0.809 . . . . 0.0 113.186 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -76.09 -28.43 57.56 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.396 -176.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -80.12 -28.78 38.92 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.691 0.758 . . . . 0.0 110.076 177.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -76.42 85.45 3.16 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 122.118 0.961 . . . . 0.0 110.664 178.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.0 mt -78.01 -23.29 13.79 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.903 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -83.19 -10.97 58.3 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.907 0.384 . . . . 0.0 111.134 -175.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.34 37.55 70.6 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -94.97 -16.89 22.43 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 121.647 0.737 . . . . 0.0 109.417 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 97.47 -14.75 63.02 Favored Glycine 0 N--CA 1.444 -0.825 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -177.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.412 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 2.1 mp0 -133.98 138.36 45.38 Favored 'General case' 0 CA--C 1.49 -1.361 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 178.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.57 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.7 OUTLIER -80.75 121.46 34.26 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 CA-C-O 121.183 0.516 . . . . 0.0 111.815 -177.904 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.574 ' HB3' ' OE2' ' A' ' 140' ' ' GLU . 50.8 t30 -87.99 166.67 14.32 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.925 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.555 ' O ' HG13 ' A' ' 142' ' ' VAL . 91.1 t80 -61.07 -45.44 94.71 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 123.223 0.609 . . . . 0.0 112.318 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.48 ' O ' HG22 ' A' ' 142' ' ' VAL . 15.1 mm-40 -65.41 -40.86 93.89 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.282 0.563 . . . . 0.0 111.732 -178.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.574 ' OE2' ' HB3' ' A' ' 137' ' ' ASN . 4.8 mp0 -60.54 -43.62 97.0 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.272 175.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -60.09 -47.04 87.55 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.881 176.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.555 HG13 ' O ' ' A' ' 138' ' ' TYR . 4.4 m -63.6 -39.2 84.47 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.491 -178.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -65.49 -42.5 92.1 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.042 -176.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.473 ' HG3' ' N ' ' A' ' 145' ' ' MET . 3.4 ptm -78.62 -37.55 41.94 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 119.937 -0.705 . . . . 0.0 111.726 -178.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.473 ' N ' ' HG3' ' A' ' 144' ' ' MET . 3.0 tmm? . . . . . 0 C--N 1.316 -0.874 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.999 -171.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 mttt . . . . . 0 CA--C 1.513 -0.473 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -73.54 -43.06 60.84 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 176.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.68 -34.86 65.07 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.857 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -73.43 -36.11 65.89 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -58.57 -53.88 53.39 Favored 'General case' 0 CA--C 1.493 -1.214 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 174.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -57.52 -40.19 78.18 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 114.553 -1.203 . . . . 0.0 112.756 176.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.85 -54.72 38.29 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 122.46 0.304 . . . . 0.0 111.382 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.573 ' O ' ' HB3' ' B' ' 93' ' ' LYS . 44.3 pt -64.33 -35.82 75.29 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 CA-C-O 120.941 0.4 . . . . 0.0 110.611 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -69.59 -41.16 76.15 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.421 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.423 ' HE3' ' HB3' ' A' ' 39' ' ' LEU . 23.4 tptm -65.34 -45.49 84.02 Favored 'General case' 0 C--O 1.205 -1.248 0 C-N-CA 122.701 0.401 . . . . 0.0 110.508 -177.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.6 -47.55 11.97 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -175.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.573 ' HB3' ' O ' ' B' ' 89' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.473 0.725 0 CA-C-O 121.529 0.68 . . . . 0.0 112.083 -177.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 tp . . . . . 0 N--CA 1.441 -0.905 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 45.5 p -80.73 156.2 26.36 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.869 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -57.22 -33.33 67.43 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 123.45 0.7 . . . . 0.0 112.345 -174.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.512 ' CD ' ' H ' ' A' ' 7' ' ' GLU . 2.0 mp0 -61.01 -46.2 91.73 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.022 0.915 . . . . 0.0 109.293 178.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.463 ' O ' ' HB3' ' A' ' 11' ' ' GLU . 62.0 tt0 -75.08 -33.17 61.62 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 114.623 -1.172 . . . . 0.0 110.14 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.628 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 67.3 mt -63.98 -37.32 79.5 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.57 -40.89 88.83 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 122.631 0.372 . . . . 0.0 110.725 175.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.463 ' HB3' ' O ' ' A' ' 8' ' ' GLN . 10.3 tp10 -57.13 -50.75 71.84 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 174.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -62.68 -30.27 71.27 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.936 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.628 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 91.1 mttt -62.14 -48.26 80.89 Favored 'General case' 0 C--O 1.252 1.224 0 CA-C-O 121.243 0.544 . . . . 0.0 110.477 179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -71.98 -43.73 64.66 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.103 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.56 -48.58 74.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.927 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.54 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 56.7 t80 -58.15 -55.34 36.28 Favored 'General case' 0 C--O 1.189 -2.098 0 C-N-CA 124.082 0.953 . . . . 0.0 110.425 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.9 m -68.72 -17.02 63.99 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 123.402 0.438 . . . . 0.0 111.677 -174.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.87 -43.25 84.05 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 174.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.639 ' HB2' HG11 ' A' ' 35' ' ' VAL . 35.2 p90 -96.6 -24.06 16.21 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 119.713 -0.795 . . . . 0.0 111.945 -178.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -79.18 81.55 5.43 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 168.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -58.45 -31.43 67.77 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.466 -1.697 . . . . 0.0 114.241 -169.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.435 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 34.3 m-20 -88.05 -13.0 42.66 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.311 -0.956 . . . . 0.0 111.845 178.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.94 61.09 6.77 Favored Glycine 0 CA--C 1.518 0.233 0 O-C-N 123.285 0.365 . . . . 0.0 112.318 -179.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.435 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 5.3 m-20 -111.09 -16.8 13.39 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.108 0.48 . . . . 0.0 109.889 -175.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.8 13.87 64.02 Favored Glycine 0 C--O 1.215 -1.087 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -174.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.598 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 17.2 p -143.41 138.42 29.34 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 122.989 0.516 . . . . 0.0 109.973 177.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mt -104.81 127.7 59.08 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 177.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.7 p -98.86 171.55 8.0 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.1 p -58.93 -39.41 81.49 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 120.984 0.421 . . . . 0.0 110.502 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -50.66 -55.1 17.98 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.014 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -66.82 -44.29 81.53 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.755 -174.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 75.6 mt -53.6 -51.68 62.26 Favored 'General case' 0 CA--C 1.51 -0.579 0 O-C-N 123.851 0.719 . . . . 0.0 111.105 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.534 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -72.9 -37.02 57.09 Favored Glycine 0 C--O 1.192 -2.471 0 C-N-CA 119.25 -1.452 . . . . 0.0 112.832 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.2 m -58.73 -48.36 81.44 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-N 118.593 1.196 . . . . 0.0 110.716 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.639 HG11 ' HB2' ' A' ' 19' ' ' PHE . 17.0 m -67.59 -34.71 69.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.31 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.3 mtm -73.37 -37.0 66.18 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 31.2 mtm180 -66.43 -30.31 70.64 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.7 m -71.74 -30.68 65.88 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.496 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.7 mt -84.07 -15.18 48.36 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.816 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.5 37.1 1.97 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.697 -0.764 . . . . 0.0 114.633 175.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -148.42 131.17 16.0 Favored 'General case' 0 CA--C 1.503 -0.858 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 173.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -114.98 80.36 6.74 Favored Pre-proline 0 C--N 1.31 -1.133 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.639 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -76.12 154.44 37.33 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.154 1.903 . . . . 0.0 110.688 175.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.6 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 51.8 p -83.31 164.05 20.29 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -178.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -66.56 -27.1 67.47 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 -177.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.24 -45.13 91.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.313 0.577 . . . . 0.0 109.685 175.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' A' ' 51' ' ' MET . 34.5 mt-10 -67.49 -48.3 67.51 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.621 178.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 44' ' ' THR . 73.9 mt -57.27 -41.32 79.46 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.162 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 -70.42 -35.59 73.51 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.02 -178.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.47 -41.01 85.3 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.451 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 66.4 mtt -54.89 -46.07 74.77 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.194 176.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 67.6 mt -67.19 -55.11 18.82 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.778 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.311 178.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.448 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.6 t30 -55.72 -32.64 63.52 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -171.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -61.73 -36.75 81.88 Favored 'General case' 0 N--CA 1.385 -3.707 0 C-N-CA 123.408 0.683 . . . . 0.0 112.587 178.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.538 HG11 ' HB2' ' A' ' 71' ' ' MET . 34.5 m -98.43 -13.95 7.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-O 120.909 0.385 . . . . 0.0 110.149 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.448 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 33.2 t0 -79.21 105.61 10.66 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.89 -177.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.49 -9.31 56.48 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.964 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.17 -11.8 31.88 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.197 -176.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.99 37.59 91.68 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.799 -176.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -115.17 -14.96 11.71 Favored 'General case' 0 C--N 1.32 -0.712 0 O-C-N 122.673 -0.31 . . . . 0.0 111.248 -176.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.23 23.16 32.78 Favored Glycine 0 N--CA 1.433 -1.517 0 C-N-CA 120.438 -0.886 . . . . 0.0 113.385 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.7 p -133.57 136.74 45.12 Favored 'General case' 0 C--O 1.252 1.203 0 CA-C-N 117.37 0.585 . . . . 0.0 111.379 178.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.598 ' O ' ' HA ' ' A' ' 26' ' ' THR . 51.2 mt -91.69 110.74 23.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.121 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -75.35 154.9 37.01 Favored 'General case' 0 C--N 1.279 -2.461 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.462 ' CZ ' ' HG2' ' A' ' 13' ' ' LYS . 63.1 t80 -51.41 -51.62 67.27 Favored Pre-proline 0 C--N 1.311 -1.093 0 O-C-N 123.422 0.451 . . . . 0.0 111.668 176.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -49.98 -40.74 49.52 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.707 2.272 . . . . 0.0 112.397 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -69.6 -40.64 76.54 Favored 'General case' 0 C--O 1.22 -0.449 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.54 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 38.4 t80 -58.55 -40.49 83.17 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.205 0.602 . . . . 0.0 109.563 174.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 94.1 mt -64.94 -51.6 60.93 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.747 176.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 74.3 m -57.04 -45.87 82.84 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.826 0.45 . . . . 0.0 111.018 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.538 ' HB2' HG11 ' A' ' 55' ' ' VAL . 26.9 ttp -58.68 -44.09 90.15 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.49 0.716 . . . . 0.0 111.642 178.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.441 ' HE3' ' CE1' ' A' ' 68' ' ' PHE . 2.5 tpp -74.61 -36.3 62.95 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.153 -177.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.22 -48.57 80.86 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.269 177.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -70.12 -16.44 63.11 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.409 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.41 ' HD3' ' OE1' ' B' ' 90' ' ' GLN . 39.3 ttmt -88.82 -16.25 32.52 Favored 'General case' 0 C--N 1.297 -1.716 0 C-N-CA 123.032 0.533 . . . . 0.0 111.632 178.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.9 ttp . . . . . 0 C--O 1.244 0.812 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 -167.266 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 . . . . . 0 N--CA 1.418 -2.031 0 CA-C-O 120.662 0.267 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -68.85 -38.46 79.81 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.76 -173.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -56.76 -38.21 72.14 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.214 0.53 . . . . 0.0 110.058 175.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.489 HG21 HG12 ' A' ' 142' ' ' VAL . 15.0 mm -68.2 -46.83 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.693 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.5 ttm180 -71.02 -29.73 65.74 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 114.314 -1.312 . . . . 0.0 112.588 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -68.06 -44.47 76.27 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.504 0.669 . . . . 0.0 109.625 174.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.471 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -68.52 -24.29 64.63 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.741 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -81.46 -42.01 20.95 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 121.121 0.486 . . . . 0.0 109.903 176.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -57.39 -33.23 67.62 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.072 1.349 . . . . 0.0 112.612 -177.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.487 HG22 HG21 ' A' ' 108' ' ' VAL . 11.6 p -58.42 -31.08 42.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.255 178.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.507 ' HB3' HG23 ' A' ' 100' ' ' ILE . 61.2 m-85 -93.86 -60.93 1.64 Allowed 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -85.79 87.19 7.37 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 122.313 1.054 . . . . 0.0 110.149 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -78.51 -39.89 36.77 Favored 'General case' 0 C--N 1.288 -2.077 0 CA-C-N 113.399 -1.728 . . . . 0.0 111.259 -175.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -79.79 -13.15 59.63 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.919 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.87 50.88 5.35 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.309 -0.948 . . . . 0.0 110.921 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -97.9 -12.63 21.86 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-O 121.268 0.556 . . . . 0.0 109.835 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.403 ' O ' ' HA ' ' A' ' 137' ' ' ASN . . . 78.79 20.42 70.95 Favored Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.935 176.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.417 ' HA ' ' O ' ' A' ' 136' ' ' VAL . 21.8 p90 -150.52 154.89 38.43 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 117.037 0.418 . . . . 0.0 110.669 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.552 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.2 mt -110.65 137.62 42.27 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 177.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 14.8 m -116.69 154.72 30.09 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 123.973 0.796 . . . . 0.0 109.507 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.71 -44.15 82.43 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -175.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.68 -49.16 76.23 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.643 0.258 . . . . 0.0 110.945 -178.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -55.42 -46.62 76.65 Favored 'General case' 0 CA--C 1.501 -0.928 0 C-N-CA 123.164 0.586 . . . . 0.0 110.33 176.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.417 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.4 tt -59.16 -44.65 92.14 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-N 115.087 -0.96 . . . . 0.0 108.899 -173.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.666 ' HG3' HG21 ' A' ' 121' ' ' VAL . 33.0 mtp180 -62.29 -37.19 84.58 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 120.977 0.418 . . . . 0.0 111.805 174.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -60.96 -44.94 96.59 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.663 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.487 HG21 HG22 ' A' ' 91' ' ' VAL . 8.9 p -72.84 -31.39 36.09 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.213 0 C-N-CA 119.71 -0.796 . . . . 0.0 110.375 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.511 ' HG3' HD12 ' A' ' 116' ' ' LEU . 21.8 mmt -64.22 -44.73 90.98 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-O 120.57 0.224 . . . . 0.0 111.433 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 22.2 m -61.41 -33.55 73.88 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.245 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -75.21 -31.58 60.94 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.918 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.9 mt -81.88 -18.36 44.06 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.647 0.737 . . . . 0.0 109.904 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 86.09 21.93 50.62 Favored Glycine 0 N--CA 1.433 -1.552 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.54 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -101.6 122.28 43.56 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -83.16 107.88 16.03 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 123.475 0.484 . . . . 0.0 110.135 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.511 HD12 ' HG3' ' A' ' 109' ' ' MET . 20.8 mt -124.97 152.13 44.57 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 176.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 50.9 p -87.06 174.5 8.62 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -71.65 -30.09 65.35 Favored 'General case' 0 C--O 1.207 -1.134 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 175.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.9 -49.45 77.41 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.559 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -56.86 -55.22 37.22 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.166 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.666 HG21 ' HG3' ' A' ' 106' ' ' ARG . 11.3 m -68.5 -32.0 53.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.372 -175.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -67.42 -44.9 77.65 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -63.87 -39.7 94.81 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 123.472 0.483 . . . . 0.0 110.337 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.3 mtt -52.6 -54.16 36.81 Favored 'General case' 0 CA--C 1.499 -0.989 0 O-C-N 124.133 0.896 . . . . 0.0 110.452 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mm -65.39 -55.73 18.75 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.192 0 O-C-N 123.777 0.673 . . . . 0.0 110.448 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 50.7 ttt180 -49.06 -47.07 45.25 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 125.145 1.378 . . . . 0.0 113.989 -173.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -82.8 -27.2 31.11 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.665 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.86 -19.96 47.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 122.309 1.052 . . . . 0.0 109.454 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 134' ' ' GLY . 9.5 t70 -73.23 74.51 1.3 Allowed 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.643 176.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.1 mt -75.89 -14.65 15.22 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 CA-C-N 114.342 -1.299 . . . . 0.0 107.922 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -81.66 -10.29 59.44 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.695 -1.139 . . . . 0.0 109.788 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 59.97 31.34 72.15 Favored Glycine 0 C--N 1.34 0.773 0 CA-C-N 115.013 -0.994 . . . . 0.0 113.757 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -115.42 -11.72 11.81 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 121.531 0.681 . . . . 0.0 111.15 -173.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.424 ' H ' ' CG ' ' A' ' 129' ' ' ASP . . . 94.81 14.78 48.34 Favored Glycine 0 C--N 1.304 -1.201 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -177.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -143.71 124.51 14.22 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.552 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.9 OUTLIER -88.79 112.86 24.62 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.88 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.988 179.203 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.403 ' HA ' ' O ' ' A' ' 98' ' ' GLY . 48.4 m-80 -81.84 160.99 23.37 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.939 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.441 ' O ' HG13 ' A' ' 142' ' ' VAL . 71.7 t80 -57.24 -42.36 81.3 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.692 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -62.22 -21.58 65.25 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -87.87 -44.91 10.72 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -62.97 -38.45 91.16 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.376 -1.284 . . . . 0.0 112.609 -177.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.489 HG12 HG21 ' A' ' 85' ' ' ILE . 25.5 m -57.14 -30.43 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-O 121.18 0.515 . . . . 0.0 111.982 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -79.28 -26.38 42.35 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 121.495 0.664 . . . . 0.0 111.178 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 85.5 mtp -80.06 -19.13 48.26 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.898 -175.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.438 ' HG2' ' CD1' ' A' ' 85' ' ' ILE . 58.4 tpp . . . . . 0 C--N 1.32 -0.702 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . 0.504 ' HE3' ' OE1' ' B' ' 83' ' ' GLU . 2.9 tmmm? . . . . . 0 N--CA 1.446 -0.632 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . 0.504 ' OE1' ' HE3' ' B' ' 82' ' ' LYS . 11.9 mm-40 -65.9 -26.85 67.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.521 0.201 . . . . 0.0 111.326 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.72 -56.07 26.46 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 172.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.491 ' O ' HG12 ' B' ' 89' ' ' ILE . 60.4 m95 -61.51 -42.55 98.98 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.186 176.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . 0.403 ' HG2' ' OE1' ' B' ' 83' ' ' GLU . 19.0 tptm -49.0 -55.18 12.72 Favored 'General case' 0 CA--C 1.501 -0.904 0 C-N-CA 125.424 1.49 . . . . 0.0 110.057 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -63.42 -46.43 86.39 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.305 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.16 -52.52 65.35 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 123.538 0.524 . . . . 0.0 112.387 -177.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.491 HG12 ' O ' ' B' ' 85' ' ' TRP . 29.3 pt -68.92 -29.18 42.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.129 0.49 . . . . 0.0 111.225 -177.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . 0.41 ' OE1' ' HD3' ' A' ' 75' ' ' LYS . 8.2 tt0 -78.25 -42.77 30.1 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.652 -179.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 12.0 tppt? -55.28 -37.65 67.58 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.063 1.345 . . . . 0.0 109.235 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . 0.428 ' HB2' HG11 ' A' ' 91' ' ' VAL . . . -63.43 -31.49 72.66 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.54 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 94.5 mttt . . . . . 0 N--CA 1.433 -1.308 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.638 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.454 ' HB3' HD11 ' A' ' 9' ' ' ILE . 11.4 tp . . . . . 0 N--CA 1.421 -1.905 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.48 ' O ' HG13 ' A' ' 9' ' ' ILE . 34.5 p -86.76 143.52 27.48 Favored 'General case' 0 N--CA 1.42 -1.929 0 C-N-CA 123.214 0.606 . . . . 0.0 110.811 -177.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -52.19 -46.76 65.68 Favored 'General case' 0 C--O 1.244 0.786 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -174.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -60.32 -46.32 90.29 Favored 'General case' 0 CA--C 1.512 -0.488 0 O-C-N 123.269 0.356 . . . . 0.0 110.548 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.408 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 23.0 tp60 -66.13 -37.84 86.7 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.659 -178.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.503 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 30.5 mt -63.5 -43.01 98.17 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.0 177.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.79 -41.83 91.47 Favored 'General case' 0 C--O 1.259 1.584 0 CA-C-O 121.399 0.618 . . . . 0.0 110.935 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -60.68 -43.82 97.25 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.126 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.416 ' CZ ' ' HG3' ' A' ' 72' ' ' MET . 19.4 m-85 -62.92 -40.83 98.8 Favored 'General case' 0 C--O 1.168 -3.234 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.984 175.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -47.99 -52.54 19.41 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.388 0.613 . . . . 0.0 111.987 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -66.75 -48.14 70.02 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.0 -177.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.05 -31.53 69.19 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.434 0.635 . . . . 0.0 111.902 -177.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -65.41 -40.3 93.21 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 124.591 1.156 . . . . 0.0 109.702 177.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 26.1 m -69.87 -25.51 63.75 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.066 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -70.89 -43.19 68.86 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -66.04 -43.05 88.65 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.339 178.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -69.76 101.27 1.66 Allowed 'General case' 0 C--N 1.313 -1.017 0 O-C-N 123.947 0.779 . . . . 0.0 109.848 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -77.19 1.92 16.98 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -109.44 -13.78 14.53 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 175.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.39 24.54 73.67 Favored Glycine 0 N--CA 1.437 -1.234 0 CA-C-N 114.608 -1.178 . . . . 0.0 112.164 -176.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -98.95 -18.54 17.78 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 119.572 -0.851 . . . . 0.0 112.205 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.25 29.73 7.77 Favored Glycine 0 C--N 1.307 -1.033 0 C-N-CA 120.677 -0.773 . . . . 0.0 114.603 175.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.8 p -145.43 129.86 17.81 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 173.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 51.6 mt -101.7 115.45 43.51 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.987 -177.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.9 p -84.66 178.01 7.83 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.522 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.7 p -64.83 -29.25 70.2 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.475 0.655 . . . . 0.0 109.55 176.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -59.23 -57.85 11.2 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.772 177.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -64.48 -39.4 93.73 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 114.265 -1.334 . . . . 0.0 111.093 -177.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.5 mt -56.17 -57.5 11.91 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 123.373 0.421 . . . . 0.0 110.548 175.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.72 -31.31 79.66 Favored Glycine 0 C--O 1.211 -1.285 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.366 -178.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.9 m -69.13 -46.99 66.26 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 116.839 0.32 . . . . 0.0 110.825 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 28.4 m -70.69 -28.64 34.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 121.306 0.575 . . . . 0.0 110.755 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.532 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 22.2 mtt -68.81 -40.81 79.35 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 173.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -66.35 -30.57 71.0 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 123.851 0.86 . . . . 0.0 110.891 178.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.7 m -64.53 -25.95 68.21 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.462 0.649 . . . . 0.0 110.132 176.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -106.34 13.92 28.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.023 178.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.1 34.65 41.01 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 115.386 0.914 . . . . 0.0 115.386 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.459 ' C ' HD22 ' A' ' 42' ' ' ASN . 4.8 tt0 -131.22 129.84 42.15 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 118.295 1.047 . . . . 0.0 109.853 176.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.459 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.82 86.02 45.36 Favored Pre-proline 0 C--N 1.305 -1.347 0 O-C-N 122.126 -0.359 . . . . 0.0 110.489 176.75 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.532 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 16.6 Cg_exo -70.02 163.62 37.82 Favored 'Trans proline' 0 C--O 1.246 0.905 0 C-N-CA 122.992 2.461 . . . . 0.0 111.96 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.505 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 44.0 p -73.85 142.96 46.06 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 174.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -72.13 -19.08 61.84 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.034 -174.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.83 -39.72 92.8 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.095 174.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.505 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 37.8 mm-40 -65.14 -42.54 93.71 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 69.9 mt -65.89 -40.55 91.65 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.82 -1.082 . . . . 0.0 112.983 -175.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.29 -44.96 93.56 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.82 177.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -64.16 -38.04 89.61 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.984 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 38.4 tpp -60.11 -50.89 71.91 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.977 -1.011 . . . . 0.0 109.798 178.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.8 mt -60.79 -51.79 69.1 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.483 177.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.407 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 12.2 t30 -63.92 -13.4 45.29 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -173.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -72.28 -40.99 67.2 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.599 HG11 ' HB2' ' A' ' 71' ' ' MET . 22.0 m -97.24 -21.98 5.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.211 -176.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 34.9 t0 -72.36 112.08 8.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.299 -179.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.51 -27.12 24.2 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-O 121.194 0.521 . . . . 0.0 110.914 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.33 -11.81 31.5 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -174.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.52 58.68 12.67 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.414 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -102.88 -16.83 15.77 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.2 23.35 34.91 Favored Glycine 0 N--CA 1.419 -2.451 0 N-CA-C 108.83 -1.708 . . . . 0.0 108.83 -173.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 49.4 p -140.35 137.13 33.84 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-N 115.567 -0.316 . . . . 0.0 111.039 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 57.5 mt -91.03 104.77 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.538 0 N-CA-C 104.269 -2.493 . . . . 0.0 104.269 173.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -84.0 168.17 16.2 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.553 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 57.8 t80 -52.87 -56.01 27.61 Favored Pre-proline 0 CA--C 1.554 1.128 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -175.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.75 -39.79 75.95 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 122.621 2.214 . . . . 0.0 112.547 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -70.38 -37.6 74.57 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.309 0.576 . . . . 0.0 110.056 -177.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -62.76 -41.97 99.47 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 72.2 mt -62.24 -49.28 76.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.014 178.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.1 m -56.87 -42.8 80.44 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.356 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.599 ' HB2' HG11 ' A' ' 55' ' ' VAL . 32.1 ttp -58.76 -46.68 86.9 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.165 0.586 . . . . 0.0 111.689 178.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.416 ' HG3' ' CZ ' ' A' ' 12' ' ' PHE . 23.2 mmt -71.76 -37.39 70.5 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.716 -177.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.31 -43.19 99.4 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -63.39 -28.94 70.33 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.69 176.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -69.01 -38.3 79.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 62.9 mtt . . . . . 0 C--N 1.318 -0.802 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.51 179.226 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 . . . . . 0 C--O 1.222 -0.394 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -66.33 -50.11 64.71 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 120.839 0.352 . . . . 0.0 111.668 -172.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -84.68 -26.0 28.04 Favored 'General case' 0 CA--C 1.494 -1.186 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.991 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.404 HD12 ' HG2' ' A' ' 145' ' ' MET . 4.9 mm -72.79 -36.69 53.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.733 -175.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -73.13 -30.94 63.97 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 176.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -67.99 -46.18 72.01 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.93 -27.91 69.17 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.024 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -76.55 -46.3 26.96 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -57.48 -38.7 74.97 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.529 1.132 . . . . 0.0 111.43 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.594 ' O ' ' HE2' ' A' ' 94' ' ' LYS . 11.6 p -68.06 -19.85 25.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.754 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -96.19 -52.39 4.03 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.742 177.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -80.46 100.94 8.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.576 0.703 . . . . 0.0 111.073 -178.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.594 ' HE2' ' O ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -78.52 -24.04 45.97 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.487 -0.779 . . . . 0.0 113.081 -179.424 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.91 -13.89 52.37 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.556 -0.858 . . . . 0.0 110.523 -176.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.28 43.26 95.49 Favored Glycine 0 CA--C 1.499 -0.924 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 178.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -101.61 -19.27 15.52 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 120.951 0.405 . . . . 0.0 110.603 -174.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.96 11.52 60.1 Favored Glycine 0 C--N 1.314 -0.684 0 C-N-CA 119.517 -1.325 . . . . 0.0 111.366 -179.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.554 ' HB3' HE21 ' A' ' 135' ' ' GLN . 51.9 m-85 -140.93 130.74 24.31 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.426 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.0 mt -103.59 133.74 46.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.8 t -100.95 158.94 15.62 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.88 -42.56 76.83 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 177.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.18 -33.52 75.65 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.772 177.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.511 ' O ' ' HB3' ' A' ' 107' ' ' HIS . 4.2 tp10 -65.52 -49.44 68.98 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 174.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.552 ' O ' ' HG2' ' A' ' 109' ' ' MET . 22.0 mt -56.52 -48.23 77.66 Favored 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.4 -176.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.403 ' HB2' HG21 ' A' ' 121' ' ' VAL . 2.1 tmm_? -56.1 -43.96 78.57 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.511 ' HB3' ' O ' ' A' ' 104' ' ' GLU . 6.8 t-80 -52.87 -55.71 21.15 Favored 'General case' 0 C--O 1.254 1.316 0 C-N-CA 123.996 0.918 . . . . 0.0 111.365 176.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.461 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.6 p -73.24 -33.51 41.64 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.641 0 C-N-CA 120.243 -0.583 . . . . 0.0 111.494 -176.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.552 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.2 mmt -64.87 -43.71 92.05 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 122.432 0.293 . . . . 0.0 111.279 -178.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.6 m -62.04 -35.5 78.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -73.04 -27.21 61.62 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.113 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 78.0 mt -89.14 -21.18 23.47 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.03 -0.419 . . . . 0.0 111.73 -177.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.51 20.27 13.81 Favored Glycine 0 C--N 1.312 -0.794 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.21 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.495 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 1.4 mp0 -100.32 110.68 22.91 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 123.476 0.71 . . . . 0.0 109.779 178.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -82.03 69.63 8.78 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 122.236 1.017 . . . . 0.0 111.591 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.607 HD13 ' SD ' ' A' ' 124' ' ' MET . 56.6 mt -101.85 139.32 37.65 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 177.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 40.2 p -84.58 171.33 12.55 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.38 -31.89 73.17 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -66.15 -51.21 60.05 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.813 177.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.556 ' O ' ' HG3' ' A' ' 124' ' ' MET . 29.0 tt0 -66.56 -42.87 86.41 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.877 -176.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.53 ' HA ' ' SD ' ' A' ' 124' ' ' MET . 23.1 m -66.12 -31.36 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 120.429 -0.509 . . . . 0.0 111.169 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -68.06 -38.86 82.92 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.484 0.659 . . . . 0.0 109.702 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -66.38 -32.41 73.77 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.335 175.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.607 ' SD ' HD13 ' A' ' 116' ' ' LEU . 92.6 mtp -63.58 -45.01 92.38 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 174.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.3 mm -57.58 -50.25 77.89 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.144 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.246 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 126' ' ' ARG . 15.2 ttp180 -59.28 -25.01 63.73 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 124' ' ' MET . 30.2 mm-40 -65.83 -48.88 70.16 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.974 0.416 . . . . 0.0 111.448 173.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -91.81 -23.45 19.7 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -173.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.498 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 30.2 t70 -72.8 96.28 2.04 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 176.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.0 mt -83.53 -53.08 12.1 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.559 -176.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -79.6 -9.66 59.66 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -173.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.498 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 81.37 55.91 3.12 Favored Glycine 0 C--N 1.307 -1.041 0 C-N-CA 120.746 -0.74 . . . . 0.0 113.482 173.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -104.37 -16.18 15.2 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 98.0 -5.01 61.25 Favored Glycine 0 CA--C 1.494 -1.247 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.554 HE21 ' HB3' ' A' ' 99' ' ' TYR . 28.9 mt-30 -143.59 127.08 16.88 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.426 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.7 OUTLIER -76.05 128.43 37.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 123.795 0.684 . . . . 0.0 112.769 -176.141 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.2 m-80 -83.83 162.28 20.63 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.429 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -64.89 -39.06 92.94 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.73 -21.7 63.44 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.552 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -88.18 -39.92 14.12 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -62.88 -42.83 99.91 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.835 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 27.6 m -62.07 -30.83 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-O 121.077 0.465 . . . . 0.0 111.132 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -48.88 31.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 25.7 ttt -60.54 -42.18 95.99 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.996 0.427 . . . . 0.0 110.765 178.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.404 ' HG2' HD12 ' A' ' 85' ' ' ILE . 41.2 tpp . . . . . 0 CA--C 1.545 0.757 0 C-N-CA 123.742 0.817 . . . . 0.0 112.362 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? . . . . . 0 N--CA 1.441 -0.883 0 CA-C-O 121.657 0.741 . . . . 0.0 109.165 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.28 -26.26 64.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.689 -176.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.13 95.5 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.571 ' O ' HG12 ' B' ' 89' ' ' ILE . 86.0 m95 -65.75 -48.56 71.44 Favored 'General case' 0 CA--C 1.496 -1.097 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.063 176.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -55.93 -45.14 78.85 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 124.003 0.814 . . . . 0.0 110.771 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 27.0 m80 -61.72 -56.93 14.38 Favored 'General case' 0 C--O 1.206 -1.204 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.033 176.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.43 -51.85 63.64 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.635 ' O ' ' HE3' ' B' ' 93' ' ' LYS . 37.8 pt -62.57 -43.3 98.32 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.164 -177.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . 0.413 ' HG3' HG13 ' B' ' 89' ' ' ILE . 27.6 mt-30 -71.78 -42.98 66.48 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.0 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.495 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 21.4 tptm -56.37 -44.49 80.2 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 125.035 1.334 . . . . 0.0 111.587 178.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . 0.532 ' HB1' HG21 ' A' ' 91' ' ' VAL . . . -63.22 -32.93 74.46 Favored 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.637 -178.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.635 ' HE3' ' O ' ' B' ' 89' ' ' ILE . 8.5 mtmp? . . . . . 0 C--N 1.312 -1.043 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -174.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.41 ' HB3' HD11 ' A' ' 9' ' ' ILE . 12.8 tp . . . . . 0 N--CA 1.439 -0.989 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.7 p -90.12 143.82 26.44 Favored 'General case' 0 C--N 1.303 -1.42 0 C-N-CA 122.877 0.471 . . . . 0.0 111.718 -178.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 2.4 mp0 -46.54 -55.12 8.06 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 125.606 1.562 . . . . 0.0 113.342 -175.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -61.39 -40.8 95.68 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.188 0.595 . . . . 0.0 111.074 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.44 ' O ' ' HD2' ' A' ' 12' ' ' PHE . 6.3 tp-100 -65.81 -41.65 91.61 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.494 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 69.4 mt -63.33 -35.61 72.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.556 177.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.92 -39.12 87.29 Favored 'General case' 0 C--O 1.257 1.449 0 CA-C-O 121.093 0.473 . . . . 0.0 110.576 177.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -60.22 -48.38 81.98 Favored 'General case' 0 C--O 1.247 0.945 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 175.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.44 ' HD2' ' O ' ' A' ' 8' ' ' GLN . 28.2 m-85 -56.6 -46.52 80.82 Favored 'General case' 0 C--O 1.184 -2.393 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.727 175.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 33.9 mmtp -46.82 -49.83 19.38 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.501 0.721 . . . . 0.0 112.073 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -65.51 -57.27 8.64 Favored 'General case' 0 C--O 1.255 1.379 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.074 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.519 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -68.15 -28.54 67.39 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.806 -175.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.8 -42.58 99.19 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 123.176 0.59 . . . . 0.0 109.78 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.4 m -72.59 -18.23 61.62 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.111 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.519 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 62.8 tp -68.9 -42.18 77.23 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.099 0.475 . . . . 0.0 110.198 172.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -78.95 -35.97 42.37 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.143 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -77.17 99.32 5.38 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.683 175.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -74.42 -3.08 28.4 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.331 -0.85 . . . . 0.0 113.277 -174.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.415 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 21.6 m-20 -110.95 -13.26 14.14 Favored 'General case' 0 CA--C 1.49 -1.363 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.729 -179.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.41 23.18 68.23 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 -176.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.415 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 3.9 p-10 -97.25 -16.36 20.39 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.891 0.377 . . . . 0.0 110.044 -173.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 101.98 8.35 45.17 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 114.851 0.701 . . . . 0.0 114.851 176.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.4 p -130.53 136.55 49.05 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 118.471 1.136 . . . . 0.0 109.628 177.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.1 mt -102.89 114.64 43.05 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 176.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.0 p -87.12 172.24 10.1 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.469 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.8 p -65.79 -32.83 74.58 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.128 0.489 . . . . 0.0 110.218 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -62.43 -45.95 90.76 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.589 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -66.6 -41.65 88.09 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.74 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.444 ' HB3' ' SD ' ' A' ' 36' ' ' MET . 89.7 mt -55.64 -62.1 1.91 Allowed 'General case' 0 CA--C 1.501 -0.929 0 O-C-N 124.006 0.816 . . . . 0.0 109.874 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -59.4 -29.12 65.75 Favored Glycine 0 C--O 1.2 -1.974 0 C-N-CA 121.18 -0.533 . . . . 0.0 113.422 -175.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.1 m -73.61 -46.2 48.4 Favored 'General case' 0 CA--C 1.554 1.128 0 CA-C-N 117.606 0.703 . . . . 0.0 111.354 178.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.97 -28.21 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 121.771 0.796 . . . . 0.0 109.97 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.444 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 48.3 mtp -77.68 -28.73 51.16 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.344 177.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 80.3 ttt180 -68.57 -29.08 67.55 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 176.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.0 m -65.2 -35.45 81.1 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.157 173.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -82.65 -22.44 34.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.142 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.74 25.02 5.59 Favored Glycine 0 N--CA 1.435 -1.414 0 C-N-CA 120.816 -0.706 . . . . 0.0 114.236 178.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.417 ' HG2' ' HD3' ' A' ' 43' ' ' PRO . 7.6 tt0 -139.53 122.6 16.8 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 118.105 0.953 . . . . 0.0 109.476 176.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -141.11 89.85 9.52 Favored Pre-proline 0 C--N 1.298 -1.64 0 CA-C-O 121.71 0.766 . . . . 0.0 111.334 174.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.417 ' HD3' ' HG2' ' A' ' 41' ' ' GLN . 22.2 Cg_endo -75.95 172.42 16.31 Favored 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.785 2.324 . . . . 0.0 112.126 178.204 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 p -73.07 164.33 26.85 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.941 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -52.76 -46.81 67.67 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.802 1.241 . . . . 0.0 111.095 -176.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.46 -43.4 83.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.289 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -64.19 -43.14 95.97 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.25 0.548 . . . . 0.0 110.546 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.2 mt -68.55 -47.08 67.77 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.76 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -58.67 -46.1 87.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.47 0.653 . . . . 0.0 109.531 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -62.57 -30.86 71.63 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.6 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 34.9 tpp -83.04 -39.51 21.14 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.9 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.406 HG22 ' HB2' ' A' ' 56' ' ' ASP . 42.4 mt -57.74 -42.98 83.0 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 176.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -56.05 -18.42 9.54 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 124.272 1.029 . . . . 0.0 113.546 -177.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -70.14 -43.76 70.25 Favored 'General case' 0 N--CA 1.393 -3.323 0 O-C-N 121.667 -0.646 . . . . 0.0 110.717 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.575 HG11 ' HB2' ' A' ' 71' ' ' MET . 12.2 m -95.29 -25.29 4.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.202 0.525 . . . . 0.0 110.095 -177.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.406 ' HB2' HG22 ' A' ' 52' ' ' ILE . 25.9 t0 -67.86 115.94 7.96 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.776 -176.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.12 -27.99 57.29 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.155 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -94.55 -12.45 27.55 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -174.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.03 37.56 63.36 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -173.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.5 p-10 -104.04 -7.58 20.19 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -171.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.78 23.18 11.08 Favored Glycine 0 C--N 1.307 -1.052 0 C-N-CA 120.195 -1.002 . . . . 0.0 113.818 172.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.55 132.66 21.61 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 116.819 0.31 . . . . 0.0 110.484 177.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 52.6 mt -92.39 110.05 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 176.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -85.34 178.43 7.47 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.401 ' CE2' HD11 ' A' ' 69' ' ' LEU . 67.1 t80 -63.07 -54.79 43.04 Favored Pre-proline 0 C--N 1.298 -1.649 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -174.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -52.11 -40.05 69.38 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.616 2.21 . . . . 0.0 112.654 175.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -66.12 -40.85 90.99 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.4 0.619 . . . . 0.0 109.795 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -64.18 -40.88 97.05 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.94 177.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.401 HD11 ' CE2' ' A' ' 65' ' ' PHE . 81.1 mt -61.05 -48.45 81.68 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.56 176.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.6 m -56.92 -44.66 82.65 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 123.427 0.454 . . . . 0.0 110.257 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.575 ' HB2' HG11 ' A' ' 55' ' ' VAL . 30.5 ttp -56.99 -44.68 82.98 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.4 mmt -85.8 -32.54 21.73 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 119.086 -1.046 . . . . 0.0 112.52 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.26 -40.42 97.37 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 74' ' ' ARG . 2.5 ptm180 -66.07 -26.21 67.39 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 121.848 0.832 . . . . 0.0 110.364 178.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -87.28 -28.99 21.97 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 114.626 -1.17 . . . . 0.0 109.389 -176.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.3 ttm . . . . . 0 C--N 1.319 -0.726 0 CA-C-N 114.53 -1.213 . . . . 0.0 111.479 -177.822 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.44 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 2.1 mp0 . . . . . 0 C--O 1.211 -0.952 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 45.0 mt-10 -65.06 -59.56 4.0 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -52.93 -39.75 63.09 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.257 1.027 . . . . 0.0 109.496 176.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.4 mm -67.63 -51.26 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-N 113.376 -1.738 . . . . 0.0 110.354 -173.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 42.8 ttm105 -71.92 -30.99 65.92 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.338 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 47.6 mt-10 -61.28 -44.77 96.67 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.501 0.667 . . . . 0.0 110.181 174.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.46 -34.17 75.47 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.347 178.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -66.89 -50.32 62.84 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.946 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -66.43 -19.72 65.87 Favored 'General case' 0 N--CA 1.419 -1.998 0 C-N-CA 123.454 0.702 . . . . 0.0 112.767 -176.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.4 p -83.15 -28.72 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 C-N-CA 118.724 -1.191 . . . . 0.0 111.006 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -83.52 -48.19 10.54 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 177.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -75.87 105.33 6.85 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 175.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -77.88 -16.98 57.84 Favored 'General case' 0 C--N 1.288 -2.093 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -169.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -115.01 -13.06 11.91 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 120.262 -0.575 . . . . 0.0 111.939 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.83 55.75 5.22 Favored Glycine 0 N--CA 1.437 -1.262 0 N-CA-C 108.327 -1.909 . . . . 0.0 108.327 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -100.69 -18.47 16.51 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.065 0.46 . . . . 0.0 110.44 -174.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.64 11.99 59.99 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.256 -1.137 . . . . 0.0 110.256 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -147.46 130.59 16.4 Favored 'General case' 0 CA--C 1.498 -1.024 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -176.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.47 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.4 mt -104.74 132.63 50.99 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 175.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.3 p -109.82 160.09 16.65 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.481 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.84 -46.34 82.35 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -175.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.5 98.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.181 0.515 . . . . 0.0 109.87 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -61.62 -40.13 93.77 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.518 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 121' ' ' VAL . 4.0 tt -61.56 -43.55 98.65 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.594 ' HG3' HG21 ' A' ' 121' ' ' VAL . 31.0 mtm180 -60.89 -40.49 93.22 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 121.249 -0.181 . . . . 0.0 111.473 174.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -57.24 -50.82 71.68 Favored 'General case' 0 C--O 1.244 0.802 0 O-C-N 123.174 0.297 . . . . 0.0 111.523 178.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.2 p -68.6 -34.42 65.1 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 C-N-CA 119.819 -0.753 . . . . 0.0 110.06 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.458 ' HG3' HD12 ' A' ' 116' ' ' LEU . 23.3 mmt -65.7 -36.28 83.17 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 58.3 m -63.08 -36.9 85.13 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -69.12 -35.01 75.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.267 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 80.0 mt -87.5 -20.49 26.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -172.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 71.07 32.21 66.05 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 116.335 -0.393 . . . . 0.0 112.279 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -81.14 -25.12 37.13 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -178.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt 69.55 71.92 0.24 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.887 0.875 . . . . 0.0 111.0 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.458 HD12 ' HG3' ' A' ' 109' ' ' MET . 32.6 mt -118.61 130.58 55.96 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 37.8 p -83.47 174.09 10.92 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.909 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -57.12 -44.16 83.04 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 122.939 0.496 . . . . 0.0 111.013 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -55.57 -44.65 77.08 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 123.765 0.666 . . . . 0.0 111.251 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -69.52 -48.91 58.96 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.824 -175.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.594 HG21 ' HG3' ' A' ' 106' ' ' ARG . 7.3 m -67.88 -34.23 66.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.314 -177.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -69.87 -40.13 75.92 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.229 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 11.1 tp10 -65.62 -42.14 91.91 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 54.1 mtt -57.3 -50.91 71.43 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.65 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 121' ' ' VAL . 42.8 mm -56.01 -47.16 80.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -63.05 -29.97 71.23 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 123' ' ' GLU . 49.1 mt-10 -70.49 -42.42 71.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.016 0.436 . . . . 0.0 110.296 177.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.429 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -81.55 -33.38 31.74 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.22 -0.446 . . . . 0.0 112.01 -176.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -68.37 107.3 2.8 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 123.894 0.878 . . . . 0.0 109.975 177.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 68.9 mt -82.54 -42.41 18.38 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.752 -177.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -76.02 -11.79 60.01 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.007 0.432 . . . . 0.0 112.046 -174.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 68.84 46.98 58.15 Favored Glycine 0 N--CA 1.44 -1.063 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -99.61 -16.18 18.32 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 121.412 0.625 . . . . 0.0 110.51 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.22 -4.2 58.54 Favored Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.989 -0.624 . . . . 0.0 111.742 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -135.76 142.44 44.96 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.47 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.6 OUTLIER -100.28 126.57 53.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 O-C-N 123.595 0.559 . . . . 0.0 111.086 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -85.22 169.02 14.22 Favored 'General case' 0 CA--C 1.501 -0.908 0 O-C-N 123.679 0.612 . . . . 0.0 110.57 177.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.538 ' O ' HG13 ' A' ' 142' ' ' VAL . 92.0 t80 -60.14 -45.46 92.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.302 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.43 ' O ' HG22 ' A' ' 142' ' ' VAL . 4.1 mp0 -62.46 -29.95 70.9 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.695 0.798 . . . . 0.0 111.276 -179.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 47.4 mt-10 -82.57 -35.71 26.89 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.198 0.523 . . . . 0.0 109.736 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -69.4 -39.36 77.99 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.341 178.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.538 HG13 ' O ' ' A' ' 138' ' ' TYR . 19.5 m -58.58 -34.79 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-O 120.701 0.286 . . . . 0.0 110.524 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.41 HE21 ' HB3' ' A' ' 143' ' ' GLN . 0.9 OUTLIER -59.92 -40.86 90.3 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.364 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 70.2 mtp -86.38 -36.08 19.41 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 17.2 tpt . . . . . 0 C--N 1.314 -0.943 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.625 -177.098 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? . . . . . 0 N--CA 1.44 -0.936 0 CA-C-O 122.36 1.076 . . . . 0.0 109.14 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . 0.457 ' CD ' ' H ' ' B' ' 83' ' ' GLU . 11.8 mp0 -63.22 -49.01 75.86 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 113.209 -1.814 . . . . 0.0 108.787 178.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.27 -32.53 72.76 Favored 'General case' 0 C--O 1.192 -1.971 0 CA-C-N 115.187 -0.915 . . . . 0.0 112.09 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -64.01 -43.39 95.79 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-N 118.228 0.467 . . . . 0.0 111.74 177.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -62.82 -46.26 88.8 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -60.32 -44.51 95.4 Favored 'General case' 0 C--O 1.205 -1.245 0 CA-C-N 114.078 -1.419 . . . . 0.0 111.873 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.7 -54.41 47.43 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 123.579 0.752 . . . . 0.0 112.149 -178.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 35.3 pt -64.82 -32.21 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 121.289 0.566 . . . . 0.0 111.274 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -69.09 -51.58 37.16 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.336 177.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.408 ' HG3' ' HB3' ' A' ' 112' ' ' LEU . 4.1 tppp? -67.48 -45.19 76.6 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 123.443 0.697 . . . . 0.0 111.77 -178.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.59 -51.35 70.21 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.089 -176.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.401 ' HE2' ' HB3' ' B' ' 93' ' ' LYS . 51.3 mtpt . . . . . 0 C--N 1.318 -0.775 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.065 178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.541 HD23 HG12 ' A' ' 9' ' ' ILE . 12.3 tp . . . . . 0 N--CA 1.422 -1.826 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.1 p -78.2 143.52 37.09 Favored 'General case' 0 N--CA 1.421 -1.896 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.099 179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -55.73 -45.16 78.03 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.348 1.059 . . . . 0.0 112.512 -175.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.5 -41.18 96.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.023 0.44 . . . . 0.0 109.985 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -63.85 -42.51 97.56 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.846 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.578 HG22 ' HE3' ' A' ' 13' ' ' LYS . 65.4 mt -63.55 -37.38 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.991 176.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.68 -41.73 99.25 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.436 177.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -61.58 -44.19 97.48 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.608 175.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -59.53 -48.69 80.69 Favored 'General case' 0 C--O 1.197 -1.658 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.402 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE3' HG22 ' A' ' 9' ' ' ILE . 98.3 mttt -50.09 -43.87 51.72 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 122.966 0.506 . . . . 0.0 111.99 179.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.86 -59.44 3.29 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.405 -177.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.83 -33.6 75.09 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -175.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -63.51 -45.2 91.76 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 123.029 0.532 . . . . 0.0 110.029 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.8 m -74.11 -16.43 61.01 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.276 0.56 . . . . 0.0 110.966 178.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -79.13 -54.18 6.25 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.311 176.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -80.48 -20.73 43.04 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -174.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -67.81 101.08 1.01 Allowed 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 171.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -62.3 -7.7 4.71 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 116.083 1.883 . . . . 0.0 116.083 -171.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -109.95 -13.82 14.36 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.04 29.78 75.66 Favored Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.105 -176.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -104.34 -17.76 14.69 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.021 -0.671 . . . . 0.0 110.719 -176.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.95 4.16 63.45 Favored Glycine 0 N--CA 1.431 -1.693 0 C-N-CA 119.661 -1.257 . . . . 0.0 115.123 176.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.0 p -124.73 129.76 51.1 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 119.239 1.52 . . . . 0.0 109.582 170.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.9 mt -91.07 126.99 43.75 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.752 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.389 -174.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 p -102.57 167.01 10.2 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.15 173.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.8 p -53.73 -45.54 70.54 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 123.886 0.874 . . . . 0.0 113.005 -178.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -59.61 -34.98 73.45 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.495 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -70.35 -38.48 74.82 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.043 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.97 -47.87 84.46 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 175.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.44 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -64.28 -26.48 70.59 Favored Glycine 0 C--O 1.198 -2.151 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.473 179.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.7 m -68.99 -49.8 54.61 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 117.582 0.691 . . . . 0.0 110.565 179.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 30.4 m -70.62 -29.68 39.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.409 -0.516 . . . . 0.0 111.135 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtt -69.13 -42.86 75.46 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 40.5 ttm180 -56.3 -39.57 72.95 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.344 1.458 . . . . 0.0 109.461 178.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 m -65.58 -32.64 74.33 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.141 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 82.6 mt -87.97 -13.73 40.99 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.226 0.536 . . . . 0.0 110.275 178.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.74 47.11 2.36 Favored Glycine 0 N--CA 1.44 -1.064 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.783 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.43 ' HB2' ' HE2' ' B' ' 91' ' ' LYS . 50.1 tt0 -148.5 130.29 15.13 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 176.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -132.54 82.4 57.03 Favored Pre-proline 0 C--N 1.286 -2.175 0 C-N-CA 120.258 -0.577 . . . . 0.0 112.046 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -70.36 160.87 48.06 Favored 'Trans proline' 0 C--O 1.243 0.771 0 C-N-CA 122.581 2.187 . . . . 0.0 109.657 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.5 t -80.81 157.38 25.75 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.725 -176.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.82 -31.11 62.39 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.09 -42.66 95.13 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.726 0.298 . . . . 0.0 111.029 176.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 51' ' ' MET . 40.7 mt-10 -66.79 -43.25 84.44 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.459 0.647 . . . . 0.0 109.295 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 66.1 mt -64.31 -38.27 90.46 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.71 -178.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -66.33 -39.07 89.0 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.567 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.41 -38.99 88.69 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.677 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.408 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 24.4 mmt -60.83 -40.38 92.55 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.228 176.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.7 mt -66.19 -47.04 85.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.953 177.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.475 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.7 t30 -64.62 -12.61 47.45 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.797 -173.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -61.84 -40.17 94.36 Favored 'General case' 0 N--CA 1.392 -3.367 0 C-N-CA 123.861 0.864 . . . . 0.0 110.428 175.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.844 HG11 ' HB2' ' A' ' 71' ' ' MET . 19.3 m -112.21 -10.94 11.94 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.813 -178.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.475 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 24.3 t0 -73.53 103.23 4.08 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.371 0.605 . . . . 0.0 110.859 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.49 -11.12 49.89 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.023 -0.989 . . . . 0.0 111.693 -177.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -93.32 -11.49 32.29 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 119.869 -0.732 . . . . 0.0 110.566 -176.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 61.44 36.38 92.45 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -115.65 -12.14 11.6 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 122.732 -0.275 . . . . 0.0 110.967 -177.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.11 17.19 32.86 Favored Glycine 0 N--CA 1.434 -1.492 0 N-CA-C 115.373 0.909 . . . . 0.0 115.373 173.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.1 p -132.48 143.14 49.56 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-N 118.39 1.095 . . . . 0.0 111.49 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.9 mt -92.36 112.96 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -84.41 161.29 20.39 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 177.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.423 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 74.7 t80 -55.56 -50.04 89.22 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.685 0.394 . . . . 0.0 111.567 177.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.423 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 4.8 Cg_endo -49.68 -43.85 38.24 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 122.494 2.129 . . . . 0.0 112.671 173.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -71.78 -36.78 70.44 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.475 0.655 . . . . 0.0 110.045 -178.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -61.87 -43.82 98.06 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.751 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.1 mt -61.16 -45.45 94.6 Favored 'General case' 0 C--O 1.208 -1.131 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.269 178.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.5 m -57.12 -40.6 77.4 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 123.601 0.563 . . . . 0.0 110.536 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.844 ' HB2' HG11 ' A' ' 55' ' ' VAL . 27.5 ttp -55.51 -55.84 27.25 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.066 0.947 . . . . 0.0 112.143 -179.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -79.5 -38.55 34.13 Favored 'General case' 0 C--O 1.196 -1.711 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.26 -33.87 74.23 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -176.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -83.54 -19.17 36.15 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.896 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -83.07 -48.08 10.98 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . 0.262 1.8 ppp? . . . . . 0 N--CA 1.437 -1.115 0 CA-C-O 122.397 1.094 . . . . 0.0 113.388 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 . . . . . 0 C--O 1.205 -1.273 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 8.5 mm-40 -41.76 -59.6 1.62 Allowed 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 116.115 1.894 . . . . 0.0 116.115 -168.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -85.38 -24.78 27.41 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.908 0.861 . . . . 0.0 109.619 -175.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.45 HG23 ' HG2' ' A' ' 145' ' ' MET . 6.6 mm -73.46 -40.92 56.48 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.025 0 CA-C-N 114.436 -1.256 . . . . 0.0 108.762 -172.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -73.75 -26.67 60.78 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.855 178.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.565 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 43.1 mt-10 -64.02 -44.16 93.43 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 173.308 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -66.88 -37.01 83.6 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 114.552 -1.204 . . . . 0.0 110.803 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -72.18 -46.24 57.12 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.634 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.2 mtm180 -69.8 -18.28 63.46 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -177.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.475 HG12 ' O ' ' A' ' 88' ' ' ALA . 9.0 p -75.92 -20.57 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.037 178.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -97.0 -55.12 2.96 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -84.44 79.07 9.69 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.897 1.332 . . . . 0.0 109.367 176.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -78.59 -18.36 54.71 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 113.289 -1.778 . . . . 0.0 111.482 -176.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -91.33 -12.49 34.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.889 -177.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.83 45.79 49.74 Favored Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -94.86 -14.65 24.37 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.414 0.626 . . . . 0.0 109.967 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.18 8.09 82.22 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.552 177.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -142.95 138.95 30.48 Favored 'General case' 0 CA--C 1.491 -1.327 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -178.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.557 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.1 mt -97.56 124.98 50.8 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 174.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.6 m -102.02 150.53 23.13 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 123.831 0.707 . . . . 0.0 110.221 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.44 -45.06 81.1 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.74 -41.08 85.64 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 122.63 0.372 . . . . 0.0 110.752 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -59.15 -55.85 29.75 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.137 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.577 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.6 tt -59.93 -40.55 89.3 Favored 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.294 -172.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.448 ' HB2' HG21 ' A' ' 121' ' ' VAL . 0.0 OUTLIER -65.29 -38.87 91.57 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -63.07 -51.02 68.29 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.285 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.546 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -65.87 -31.51 54.06 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.38 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.371 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.577 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.4 mmt -62.55 -37.1 84.82 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 13.8 m -60.68 -46.55 89.92 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 175.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -69.08 -16.73 63.75 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 114.622 -1.172 . . . . 0.0 111.814 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 95.3 mt -100.9 -2.36 32.19 Favored 'General case' 0 C--N 1.316 -0.889 0 O-C-N 121.985 -0.447 . . . . 0.0 111.617 -177.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 81.02 1.24 89.84 Favored Glycine 0 C--O 1.237 0.301 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.466 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.436 ' HG3' ' SD ' ' A' ' 109' ' ' MET . 20.4 mm-40 -70.9 -48.69 52.32 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 52.08 73.47 0.32 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 124.519 1.137 . . . . 0.0 110.665 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.423 HD12 ' HG3' ' A' ' 109' ' ' MET . 82.1 mt -97.5 157.64 15.9 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.166 -177.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.4 p -76.82 158.64 30.7 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.497 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.407 ' HA ' HG22 ' A' ' 121' ' ' VAL . 3.9 p30 -67.84 -23.09 65.12 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-O 121.112 0.482 . . . . 0.0 109.892 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.81 -42.83 63.44 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 123.158 0.583 . . . . 0.0 110.375 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -68.22 -44.5 75.6 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.335 0.588 . . . . 0.0 109.863 -176.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.448 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.4 m -69.07 -29.58 43.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.143 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.84 -41.15 92.11 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.8 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -63.85 -43.51 95.94 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 55.4 mtt -53.89 -34.8 60.53 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.413 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.421 ' CG2' ' HA ' ' A' ' 135' ' ' GLN . 51.3 mm -86.23 -58.52 3.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.46 179.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.62 -38.35 86.75 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -171.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -70.15 -28.65 65.52 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.419 ' HA ' ' SD ' ' A' ' 144' ' ' MET . . . -80.18 -35.76 35.97 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.221 179.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.67 85.56 0.65 Allowed 'General case' 0 C--N 1.307 -1.276 0 CA-C-O 122.582 1.182 . . . . 0.0 112.424 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 28.9 mt -83.44 -8.74 11.41 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 CA-C-N 114.078 -1.419 . . . . 0.0 109.106 174.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.422 ' HB2' ' OE2' ' A' ' 140' ' ' GLU . 31.8 t70 -90.15 -12.47 38.11 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.607 -172.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.79 35.68 58.41 Favored Glycine 0 N--CA 1.433 -1.551 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.611 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -100.35 -16.87 17.5 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.444 0.64 . . . . 0.0 109.772 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.95 -2.28 85.53 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -176.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.421 ' HA ' ' CG2' ' A' ' 125' ' ' ILE . 21.9 mt-30 -138.37 147.29 43.27 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.634 1.173 . . . . 0.0 108.803 -178.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.557 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.4 p -86.69 121.11 37.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 C-N-CA 119.811 -0.756 . . . . 0.0 110.879 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -91.54 177.07 6.32 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.987 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.404 ' O ' HG13 ' A' ' 142' ' ' VAL . 85.5 t80 -70.05 -41.6 73.98 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.984 -173.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.411 ' HA ' HG22 ' A' ' 142' ' ' VAL . 44.7 mt-10 -63.94 -42.13 97.43 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.095 0.474 . . . . 0.0 111.408 -179.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.422 ' OE2' ' HB2' ' A' ' 131' ' ' ASP . 0.5 OUTLIER -70.48 -30.66 67.51 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.835 177.347 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -70.75 -45.37 64.94 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.054 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.411 HG22 ' HA ' ' A' ' 139' ' ' GLU . 23.9 m -62.45 -33.91 61.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-O 120.927 0.394 . . . . 0.0 110.828 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -60.9 -46.41 90.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.966 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.419 ' SD ' ' HA ' ' A' ' 128' ' ' ALA . 40.1 mtm -75.23 -40.17 59.29 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.693 -178.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.45 ' HG2' HG23 ' A' ' 85' ' ' ILE . 10.0 tpt . . . . . 0 C--N 1.32 -0.701 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.508 -175.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt . . . . . 0 C--O 1.247 0.947 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -80.26 -44.06 20.29 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.099 0.476 . . . . 0.0 110.147 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.84 -37.16 83.43 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.055 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.443 ' O ' HG13 ' B' ' 89' ' ' ILE . 48.2 m95 -57.56 -45.66 84.87 Favored 'General case' 0 C--O 1.206 -1.235 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 176.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -55.56 -49.51 72.48 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 122.512 1.149 . . . . 0.0 109.811 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -66.41 -36.6 83.25 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 113.149 -1.841 . . . . 0.0 111.195 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -77.44 -41.28 40.36 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.443 HG13 ' O ' ' B' ' 85' ' ' TRP . 83.1 mt -57.85 -50.99 75.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 122.943 0.497 . . . . 0.0 111.886 -178.169 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -68.18 -31.39 70.9 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.615 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' A' ' 112' ' ' LEU . 3.6 tppp? -65.99 -46.29 78.53 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.839 177.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.69 92.63 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.265 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 96.6 mttt . . . . . 0 N--CA 1.466 0.359 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.299 178.863 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.429 HD23 HG12 ' A' ' 9' ' ' ILE . 9.3 tp . . . . . 0 N--CA 1.442 -0.828 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.0 p -82.32 145.36 29.99 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -176.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -51.08 -50.59 58.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.812 1.245 . . . . 0.0 113.371 -176.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -66.72 -34.96 79.01 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.257 0.551 . . . . 0.0 110.705 -177.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.615 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 52.0 tp60 -74.36 -36.33 63.59 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.307 -178.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.429 HG12 HD23 ' A' ' 4' ' ' LEU . 68.8 mt -60.55 -40.67 85.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.939 176.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.93 -38.81 92.5 Favored 'General case' 0 C--O 1.255 1.376 0 CA-C-O 121.334 0.588 . . . . 0.0 110.647 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -62.88 -45.51 92.19 Favored 'General case' 0 C--O 1.249 1.059 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.255 177.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.615 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 23.1 m-85 -60.45 -38.75 85.17 Favored 'General case' 0 C--O 1.197 -1.667 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.837 178.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.479 ' HG2' ' CZ ' ' A' ' 65' ' ' PHE . 98.9 mttt -55.17 -51.12 67.51 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 121.026 0.441 . . . . 0.0 111.304 177.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -68.04 -46.85 69.99 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.291 -178.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.606 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -70.52 -21.87 62.69 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.995 -176.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -67.51 -53.56 27.54 Favored 'General case' 0 CA--C 1.486 -1.513 0 C-N-CA 123.41 0.684 . . . . 0.0 109.408 174.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 t -67.4 -16.82 64.45 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 121.018 0.437 . . . . 0.0 110.359 -177.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.606 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 16.7 tp -59.35 -46.84 87.52 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.56 172.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.628 ' HB2' HG11 ' A' ' 35' ' ' VAL . 25.2 p90 -101.42 -25.79 13.81 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.985 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -75.98 99.15 4.47 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 174.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -48.96 -34.52 13.11 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 116.767 2.136 . . . . 0.0 116.767 -170.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.1 p30 -110.47 -13.11 14.31 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 27.58 73.66 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.813 -0.232 . . . . 0.0 112.851 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -81.65 -16.48 51.26 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.165 0.507 . . . . 0.0 110.952 -176.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.43 0.26 46.83 Favored Glycine 0 N--CA 1.434 -1.442 0 C-N-CA 120.657 -0.783 . . . . 0.0 114.252 -178.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.446 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 67.2 p -128.89 129.4 45.48 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 118.898 1.349 . . . . 0.0 109.955 173.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.6 mt -89.38 111.97 23.68 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 179.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.6 p -87.74 170.04 11.58 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.993 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.3 p -63.02 -33.57 75.71 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 123.019 0.2 . . . . 0.0 110.852 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -52.61 -54.82 27.92 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.253 174.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.75 -45.04 79.86 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.188 -174.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 71.5 mt -60.17 -45.68 92.28 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 178.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.98 -29.04 67.52 Favored Glycine 0 C--O 1.207 -1.532 0 C-N-CA 118.997 -1.573 . . . . 0.0 112.188 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.8 m -69.57 -44.12 71.47 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 117.255 0.528 . . . . 0.0 110.436 177.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.628 HG11 ' HB2' ' A' ' 19' ' ' PHE . 25.1 m -66.76 -36.21 76.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-O 121.149 0.499 . . . . 0.0 109.949 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.533 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 63.2 mtt -68.46 -42.51 78.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.607 176.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 68.5 ttt180 -62.85 -25.59 68.35 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 123.873 0.869 . . . . 0.0 110.819 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.0 m -63.09 -30.25 71.45 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.349 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -98.05 9.34 43.07 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 120.9 0.381 . . . . 0.0 111.077 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.42 -9.7 75.54 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.767 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.401 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 62.1 tt0 -71.8 118.36 14.55 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -113.41 84.43 7.7 Favored Pre-proline 0 C--N 1.289 -2.052 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 177.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.533 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 73.1 Cg_endo -89.65 162.33 5.25 Favored 'Trans proline' 0 N--CA 1.434 -2.015 0 C-N-CA 122.409 2.072 . . . . 0.0 111.237 177.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.2 p -89.13 167.53 13.05 Favored 'General case' 0 C--N 1.283 -2.297 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 175.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -64.84 -30.21 71.2 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.54 89.35 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.708 0.289 . . . . 0.0 110.834 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -66.8 -38.47 86.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.535 0.683 . . . . 0.0 110.584 179.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.409 HD21 ' HG2' ' A' ' 43' ' ' PRO . 77.1 mt -68.67 -44.8 73.27 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.149 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -63.49 -34.88 78.75 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.718 -1.128 . . . . 0.0 109.847 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.22 -43.19 98.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.707 177.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 14.6 tpt -69.06 -36.31 77.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.373 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 67.8 mt -63.31 -55.76 21.22 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.367 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.43 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -57.9 -31.8 67.12 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 123.411 0.684 . . . . 0.0 112.007 -175.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.47 -31.88 66.39 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 123.955 0.902 . . . . 0.0 110.048 178.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.644 HG11 ' SD ' ' A' ' 71' ' ' MET . 32.9 m -114.89 -11.4 12.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 O-C-N 121.825 -0.547 . . . . 0.0 112.12 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -76.26 114.55 15.06 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 -174.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.85 -10.39 53.54 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.191 -178.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -106.99 -12.37 15.45 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.717 -176.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.78 44.8 94.05 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -175.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -115.37 0.83 13.56 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -174.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.02 23.6 37.67 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.191 -1.004 . . . . 0.0 113.86 173.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.446 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 1.7 p -150.73 142.05 23.3 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 116.981 0.391 . . . . 0.0 111.364 179.03 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.3 mt -97.97 104.19 15.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 175.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.56 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 6.7 t70 -78.84 164.81 24.18 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 -178.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.479 ' CZ ' ' HG2' ' A' ' 13' ' ' LYS . 61.3 t80 -52.68 -50.39 81.06 Favored Pre-proline 0 CA--C 1.554 1.112 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.56 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 4.8 Cg_endo -49.81 -49.6 15.51 Favored 'Trans proline' 0 C--N 1.364 1.375 0 C-N-CA 122.735 2.29 . . . . 0.0 112.019 172.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -63.05 -37.98 89.37 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.268 0.556 . . . . 0.0 109.753 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.417 ' O ' ' HG2' ' A' ' 72' ' ' MET . 39.7 t80 -64.33 -39.34 93.7 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.417 178.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.9 mt -66.55 -42.49 87.05 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.6 m -57.53 -45.29 85.2 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.644 ' SD ' HG11 ' A' ' 55' ' ' VAL . 42.6 ttp -64.94 -37.96 89.38 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.493 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 28.7 mmt -63.91 -43.3 96.36 Favored 'General case' 0 C--N 1.321 -0.674 0 O-C-N 122.259 -0.276 . . . . 0.0 110.863 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.97 -35.05 79.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.063 0.459 . . . . 0.0 109.895 176.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -69.88 -23.73 63.3 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.327 1.051 . . . . 0.0 110.749 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.459 ' HD3' ' O ' ' A' ' 71' ' ' MET . 4.1 mptp? -81.03 -20.41 41.76 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 121.888 -0.508 . . . . 0.0 111.377 177.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 21.5 ptp . . . . . 0 C--N 1.324 -0.521 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -171.871 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -58.29 -50.27 74.21 Favored 'General case' 0 C--O 1.205 -1.272 0 C-N-CA 123.4 0.68 . . . . 0.0 109.448 -178.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HA ' ' HB2' ' A' ' 87' ' ' GLU . 42.8 mm-40 -64.96 -29.29 70.21 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -178.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 30.0 mm -71.67 -47.28 58.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.0 ttm-85 -70.39 -30.08 66.89 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.87 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.422 ' HB2' ' HA ' ' A' ' 84' ' ' GLU . 7.5 mm-40 -56.47 -47.4 79.29 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.965 0.906 . . . . 0.0 112.162 174.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.48 94.86 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.091 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.18 -45.55 87.89 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-O 121.351 0.596 . . . . 0.0 109.51 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -56.34 -41.79 76.65 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 126.571 1.948 . . . . 0.0 111.987 -179.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.1 p -73.39 -27.06 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.118 -177.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -84.33 -60.06 2.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.647 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -79.59 81.86 5.79 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 121.981 0.896 . . . . 0.0 110.833 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -79.1 -38.43 36.24 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.493 -1.231 . . . . 0.0 111.987 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -73.55 -13.87 61.1 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 121.28 0.562 . . . . 0.0 111.036 -176.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.41 60.25 4.15 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.993 175.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 37.5 m-80 -99.33 -10.29 22.49 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.03 0.443 . . . . 0.0 110.755 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.82 1.88 84.73 Favored Glycine 0 CA--C 1.498 -0.982 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -153.5 150.13 28.43 Favored 'General case' 0 N--CA 1.412 -2.356 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.592 ' HB ' HG13 ' A' ' 136' ' ' VAL . 5.4 mt -98.55 124.36 51.66 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.114 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.1 m -101.59 159.04 15.64 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.08 -42.12 89.67 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.16 -44.3 89.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.295 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.635 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 3.1 tp10 -59.11 -46.76 87.48 Favored 'General case' 0 CA--C 1.494 -1.184 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.898 176.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.552 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.7 tt -62.3 -36.63 82.72 Favored 'General case' 0 N--CA 1.418 -2.039 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -174.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.2 -32.53 71.88 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.635 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 48.0 m170 -53.49 -55.61 23.91 Favored 'General case' 0 C--O 1.26 1.658 0 CA-C-O 121.478 0.656 . . . . 0.0 110.117 177.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.421 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.7 p -65.79 -34.68 71.94 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.06 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.538 -178.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.552 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 19.8 mmt -62.13 -43.11 99.56 Favored 'General case' 0 CA--C 1.491 -1.324 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 m -59.43 -37.78 78.95 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.033 177.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -79.02 -22.91 44.75 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.2 177.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 93.0 mt -84.96 -20.0 31.27 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.778 0.323 . . . . 0.0 110.81 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 103.0 2.67 48.85 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.569 178.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -85.3 115.73 23.23 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.326 0.584 . . . . 0.0 111.279 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -85.8 76.13 9.95 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.454 HD12 ' HG3' ' A' ' 109' ' ' MET . 66.2 mt -101.14 147.54 26.13 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.011 -177.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.9 p -83.86 165.76 18.49 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.144 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -64.78 -39.28 93.35 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 1.5 mp0 -54.5 -49.71 69.52 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.169 176.631 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -59.4 -54.5 45.95 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.902 -176.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.456 ' O ' HG12 ' A' ' 125' ' ' ILE . 18.3 m -65.78 -35.79 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.378 -175.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.579 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 11.3 t70 -66.85 -42.06 86.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.357 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -69.92 -29.15 66.25 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.172 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.445 ' HE2' ' HB1' ' B' ' 84' ' ' ALA . 66.3 mtt -58.89 -49.66 76.95 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 173.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.9 mm -53.37 -46.44 58.07 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.603 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.661 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 27.5 mmt180 -62.07 -32.34 72.86 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -175.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -79.38 -35.89 40.09 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 120.1 -0.64 . . . . 0.0 111.241 178.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.464 ' HA ' ' HG2' ' A' ' 144' ' ' MET . . . -79.81 -21.36 44.36 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 121.706 0.765 . . . . 0.0 110.467 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -82.5 88.39 6.63 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.408 173.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 61.4 mt -81.85 -42.62 19.29 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -75.8 -9.29 58.47 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.8 53.84 3.86 Favored Glycine 0 N--CA 1.438 -1.213 0 C-N-CA 120.545 -0.836 . . . . 0.0 111.813 175.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -105.38 -10.35 17.03 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 90.72 -8.81 79.25 Favored Glycine 0 CA--C 1.499 -0.941 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.115 176.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -141.35 138.3 32.97 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.592 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.8 OUTLIER -81.78 114.67 23.06 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 N-CA-C 113.159 0.799 . . . . 0.0 113.159 -175.446 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -90.66 163.62 14.46 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.779 ' O ' HG23 ' A' ' 142' ' ' VAL . 47.4 t80 -55.5 -59.92 4.15 Favored 'General case' 0 C--O 1.198 -1.62 0 CA-C-O 117.96 -1.019 . . . . 0.0 113.165 -174.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -53.71 -37.15 62.99 Favored 'General case' 0 CA--C 1.561 1.399 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -172.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -73.95 -35.07 64.52 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 120.121 -0.631 . . . . 0.0 110.44 178.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -66.51 -41.74 88.4 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.182 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 138' ' ' TYR . 6.3 t -52.6 -43.03 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.424 0 C-N-CA 124.47 1.108 . . . . 0.0 109.841 177.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -66.82 -55.92 12.7 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.92 -178.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.464 ' HG2' ' HA ' ' A' ' 128' ' ' ALA . 3.1 ppp? -76.47 -20.45 56.99 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -174.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 C--O 1.242 0.689 0 CA-C-O 120.971 0.415 . . . . 0.0 110.117 175.537 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . 0.577 ' O ' ' HG3' ' B' ' 86' ' ' LYS . 13.0 mptt . . . . . 0 C--O 1.214 -0.798 0 CA-C-O 119.811 -0.138 . . . . 0.0 111.295 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.47 -36.97 85.9 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 174.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.445 ' HB1' ' HE2' ' A' ' 124' ' ' MET . . . -65.47 -46.21 80.68 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.508 175.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -61.65 -24.91 67.04 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . 0.624 ' HG2' ' OE1' ' B' ' 90' ' ' GLN . 67.1 mttm -68.79 -31.42 70.42 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.163 0.506 . . . . 0.0 110.549 175.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . 0.561 ' O ' ' HB3' ' B' ' 91' ' ' LYS . 74.8 m80 -84.07 -29.7 26.62 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.555 177.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -86.4 -63.15 1.36 Allowed 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -177.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 64.7 mt -81.57 -58.39 3.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 O-C-N 122.198 -0.314 . . . . 0.0 111.085 -173.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . 0.624 ' OE1' ' HG2' ' B' ' 86' ' ' LYS . 46.3 mt-30 -59.1 -36.06 74.5 Favored 'General case' 0 C--O 1.202 -1.421 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.163 -178.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.561 ' HB3' ' O ' ' B' ' 87' ' ' HIS . 20.3 tptp -80.67 -33.31 35.61 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.13 -46.44 77.51 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.571 0.7 . . . . 0.0 110.744 179.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.2 mmmt . . . . . 0 C--O 1.196 -1.727 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.937 -177.64 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 4' ' ' LEU . 11.1 tp . . . . . 0 N--CA 1.425 -1.691 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.9 p -74.68 142.84 44.44 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -67.25 -30.25 70.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -171.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -63.43 -40.09 96.24 Favored 'General case' 0 C--O 1.245 0.859 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 177.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.443 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 6.6 tp-100 -72.95 -36.32 67.15 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.376 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.47 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 64.7 mt -61.64 -37.84 78.88 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.945 176.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.1 -43.12 99.36 Favored 'General case' 0 C--O 1.256 1.408 0 CA-C-O 121.646 0.736 . . . . 0.0 110.371 176.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -60.62 -41.24 94.46 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.611 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.453 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 21.3 m-85 -74.96 -12.0 60.24 Favored 'General case' 0 C--O 1.189 -2.125 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 177.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 67.7 mttm -69.58 -48.81 58.92 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 173.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.72 -39.91 88.18 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 119.699 -0.8 . . . . 0.0 110.084 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.453 ' HB3' ' HA ' ' A' ' 12' ' ' PHE . . . -69.56 -24.14 63.66 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.409 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.578 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 70.1 t80 -68.52 -52.34 33.12 Favored 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 176.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 m -69.55 -16.69 63.47 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.15 -178.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.405 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 41.5 tp -62.78 -31.86 72.91 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 173.084 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.536 ' CD2' HG21 ' A' ' 35' ' ' VAL . 8.8 m-85 -98.29 -43.13 7.08 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.771 177.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -79.43 87.44 5.06 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 122.143 0.973 . . . . 0.0 109.222 176.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 27.5 mmmt -71.27 -26.22 62.8 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 114.046 -1.434 . . . . 0.0 112.358 -172.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.605 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 1.5 m-20 -90.98 -13.17 33.88 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.754 -177.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.46 58.41 9.46 Favored Glycine 0 C--O 1.223 -0.564 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.404 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.605 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 10.3 m-20 -112.12 -16.74 12.97 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -176.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.31 11.4 58.48 Favored Glycine 0 C--N 1.313 -0.722 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 -173.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.414 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 11.2 p -144.7 136.83 26.09 Favored 'General case' 0 N--CA 1.441 -0.925 0 C-N-CA 123.369 0.668 . . . . 0.0 110.167 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 56.9 mt -104.87 127.92 59.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 p -103.18 172.91 6.55 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.922 177.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.3 p -64.34 -27.98 69.4 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.881 0.372 . . . . 0.0 111.182 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -53.18 -54.01 42.12 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 124.553 1.141 . . . . 0.0 109.392 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.526 ' HB3' ' O ' ' A' ' 19' ' ' PHE . 35.1 mt-10 -71.2 -38.81 72.05 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 113.719 -1.582 . . . . 0.0 111.271 -174.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -59.32 -49.39 78.0 Favored 'General case' 0 C--O 1.208 -1.112 0 O-C-N 123.447 0.467 . . . . 0.0 110.907 176.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.13 -27.67 72.61 Favored Glycine 0 C--O 1.222 -0.613 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.465 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.2 m -65.7 -50.08 66.18 Favored 'General case' 0 C--O 1.262 1.739 0 CA-C-O 121.693 0.759 . . . . 0.0 109.591 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.697 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 34.8 m -73.35 -41.08 57.3 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.194 -178.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -48.12 75.61 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 123.166 0.587 . . . . 0.0 110.948 177.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -58.26 -39.56 79.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.943 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.8 m -68.63 -27.32 65.91 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 121.328 0.585 . . . . 0.0 111.164 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 52.3 mt -84.1 -20.27 32.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.324 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.22 19.02 40.43 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.4 ' C ' ' HD3' ' A' ' 43' ' ' PRO . 3.4 tp-100 -106.07 120.56 42.1 Favored 'General case' 0 N--CA 1.428 -1.573 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 -178.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -126.11 69.23 66.34 Favored Pre-proline 0 C--N 1.301 -1.539 0 C-N-CA 118.663 -1.215 . . . . 0.0 112.866 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.4 ' HD3' ' C ' ' A' ' 41' ' ' GLN . 5.7 Cg_exo -77.25 163.12 30.63 Favored 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 122.293 1.995 . . . . 0.0 109.875 175.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.426 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 22.8 p -75.29 161.77 29.01 Favored 'General case' 0 C--N 1.295 -1.804 0 CA-C-O 120.46 0.172 . . . . 0.0 111.163 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -57.39 -36.1 70.85 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 177.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.17 -49.69 76.13 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.464 178.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 8.1 mm-40 -64.22 -42.59 96.52 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.755 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.34 -45.72 89.92 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.557 0.535 . . . . 0.0 111.48 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.4 tm0? -66.63 -40.12 88.6 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -62.46 -38.06 88.36 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.978 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 21.7 mmt -58.49 -40.07 81.78 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.21 175.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.9 mt -67.28 -56.54 13.13 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.15 176.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.49 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.4 t30 -57.34 -26.2 60.61 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.488 0.715 . . . . 0.0 112.554 -173.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.57 -46.11 89.83 Favored 'General case' 0 N--CA 1.427 -1.621 0 C-N-CA 123.113 0.565 . . . . 0.0 109.503 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.604 HG11 ' SD ' ' A' ' 71' ' ' MET . 35.3 m -93.71 -19.77 6.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.274 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.49 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 44.8 t0 -67.89 106.84 2.43 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.184 -179.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.55 -9.71 53.65 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.582 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -101.71 -12.56 18.28 Favored 'General case' 0 CA--C 1.497 -1.088 0 C-N-CA 119.263 -0.975 . . . . 0.0 110.284 -173.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 61.23 39.09 96.7 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -172.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -108.14 -2.23 19.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.867 0.365 . . . . 0.0 110.963 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.52 9.14 82.07 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 121.088 -0.577 . . . . 0.0 114.308 172.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.414 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 26.2 p -134.88 150.94 50.52 Favored 'General case' 0 C--O 1.256 1.416 0 CA-C-N 117.5 0.65 . . . . 0.0 111.58 179.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 45.8 mt -91.88 106.64 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 176.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -77.16 163.86 26.19 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.421 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 48.5 t80 -52.01 -53.83 47.47 Favored Pre-proline 0 CA--C 1.561 1.377 0 O-C-N 123.681 0.613 . . . . 0.0 112.33 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -52.44 -38.49 74.16 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.988 2.459 . . . . 0.0 113.341 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -71.2 -43.37 67.53 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 121.243 0.544 . . . . 0.0 110.142 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.578 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 56.5 t80 -62.57 -41.77 99.14 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.455 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 91.4 mt -63.17 -49.49 74.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.749 177.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.7 m -57.75 -46.94 83.8 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.604 ' SD ' HG11 ' A' ' 55' ' ' VAL . 16.6 ptt? -67.72 -32.07 72.45 Favored 'General case' 0 CA--C 1.507 -0.692 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.374 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.1 tpp -71.22 -37.27 72.05 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.73 -30.11 71.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.613 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -75.41 -28.69 59.52 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.019 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 71' ' ' MET . 94.4 mttt -69.85 -29.75 67.07 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.062 -179.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 4.8 mpp? . . . . . 0 N--CA 1.448 -0.528 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 166.369 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 C--O 1.234 0.273 0 CA-C-O 121.182 0.515 . . . . 0.0 111.614 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -66.53 -46.32 76.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.681 -175.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -59.39 -43.68 92.91 Favored 'General case' 0 CA--C 1.501 -0.928 0 O-C-N 124.119 0.887 . . . . 0.0 110.666 -176.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.658 ' HA ' ' SD ' ' A' ' 145' ' ' MET . 7.0 mm -63.95 -49.64 80.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.574 -1.193 . . . . 0.0 109.302 -174.271 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -69.21 -33.43 73.31 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.969 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -63.74 -53.28 53.52 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.16 -46.01 91.13 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.787 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -60.44 -48.14 83.05 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.096 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.584 ' NE ' ' HA ' ' A' ' 90' ' ' ARG . 0.8 OUTLIER -60.23 -36.66 78.22 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.187 -178.169 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.7 p -75.89 -26.01 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 120.516 -0.474 . . . . 0.0 111.602 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -80.88 -56.32 4.2 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 176.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -88.9 86.15 6.89 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 122.009 0.909 . . . . 0.0 109.201 178.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -78.02 -21.6 50.51 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.249 -174.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.547 ' HB3' ' ND2' ' A' ' 97' ' ' ASN . 13.3 t70 -83.52 -15.13 50.56 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -177.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.509 ' HA2' ' NH2' ' A' ' 90' ' ' ARG . . . 72.06 51.18 14.98 Favored Glycine 0 N--CA 1.44 -1.057 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.804 179.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.547 ' ND2' ' HB3' ' A' ' 95' ' ' ASP . 39.6 m-80 -84.1 -19.61 33.96 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.832 0.348 . . . . 0.0 110.168 -178.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.68 -2.91 86.71 Favored Glycine 0 C--O 1.227 -0.319 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.432 ' CE1' ' HB2' ' A' ' 137' ' ' ASN . 91.9 m-85 -143.47 150.11 38.51 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.2 mt -111.36 133.16 57.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 177.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.2 m -98.7 156.96 16.57 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.69 -49.48 62.52 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -173.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.26 -33.75 76.73 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 36.3 tt0 -64.96 -46.97 79.33 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.469 176.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.471 HD21 ' SD ' ' A' ' 124' ' ' MET . 9.1 tt -65.31 -36.51 84.29 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.573 ' HA ' HG11 ' A' ' 121' ' ' VAL . 26.1 ttp180 -62.38 -38.44 89.6 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 104' ' ' GLU . 44.0 m170 -61.62 -54.2 46.02 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.067 176.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 6.3 p -61.98 -36.36 73.59 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.55 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.659 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.3 mmt -64.28 -41.41 96.92 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-O 121.011 0.434 . . . . 0.0 111.08 178.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.2 m -66.07 -33.88 76.79 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 178.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -75.1 -25.17 58.31 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.539 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.4 mt -87.93 -20.36 26.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.333 0.587 . . . . 0.0 110.721 -178.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.39 -14.06 43.29 Favored Glycine 0 C--N 1.305 -1.149 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.898 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.426 ' OE2' ' HG2' ' B' ' 91' ' ' LYS . 1.1 mp0 -61.85 -42.57 99.21 Favored 'General case' 0 CA--C 1.504 -0.825 0 C-N-CA 123.043 0.537 . . . . 0.0 110.053 177.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 54.5 35.83 24.28 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.454 1.096 . . . . 0.0 111.314 176.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.5 mt -57.95 143.31 43.41 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.246 -177.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 16.7 p -70.21 168.39 15.86 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 123.599 0.562 . . . . 0.0 110.539 178.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.52 ' HA ' HG22 ' A' ' 121' ' ' VAL . 11.4 t70 -62.81 -35.39 79.76 Favored 'General case' 0 C--O 1.215 -0.735 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -177.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -53.33 -54.58 34.44 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.546 1.138 . . . . 0.0 111.024 176.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -71.69 -38.37 70.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.118 -175.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.573 HG11 ' HA ' ' A' ' 106' ' ' ARG . 11.9 m -70.95 -33.94 53.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.891 -178.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -71.97 -36.36 69.79 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -60.96 -46.37 90.99 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 175.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.471 ' SD ' HD21 ' A' ' 105' ' ' LEU . 35.5 mtt -53.53 -50.45 65.45 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.735 175.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 121' ' ' VAL . 47.3 mm -63.2 -57.2 12.99 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.506 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.557 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -54.95 -42.23 72.07 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -171.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -74.67 -30.77 61.7 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 179.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.412 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -84.0 -27.28 28.53 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.339 0.59 . . . . 0.0 110.502 -179.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.442 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 7.7 t70 -67.66 96.17 0.53 Allowed 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 125.626 1.57 . . . . 0.0 109.419 175.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.1 mt -82.68 -48.49 17.88 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.836 -176.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.86 -11.3 60.88 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 121.137 0.494 . . . . 0.0 112.245 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.442 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 72.9 47.06 26.78 Favored Glycine 0 C--N 1.306 -1.105 0 N-CA-C 110.814 -0.914 . . . . 0.0 110.814 178.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -98.73 -16.41 18.98 Favored 'General case' 0 C--N 1.306 -1.309 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -178.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.1 10.39 61.15 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -147.77 134.17 19.64 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 124.729 1.212 . . . . 0.0 107.92 -176.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.405 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 0.7 OUTLIER -88.02 121.56 38.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 CA-C-O 120.564 0.221 . . . . 0.0 111.392 -179.491 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.432 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 20.5 t30 -85.77 154.47 21.58 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.304 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.543 ' O ' HG13 ' A' ' 142' ' ' VAL . 42.1 t80 -56.01 -47.55 77.57 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.336 1.054 . . . . 0.0 110.407 178.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.55 -21.62 66.74 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.696 -178.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.426 ' HG3' ' HB3' ' A' ' 137' ' ' ASN . 43.5 mt-10 -87.97 -42.9 12.15 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 122.027 0.917 . . . . 0.0 108.734 177.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -65.9 -28.26 68.81 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.1 -177.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.565 ' HA ' HG21 ' A' ' 85' ' ' ILE . 34.6 m -60.34 -29.15 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-O 121.085 0.469 . . . . 0.0 111.638 177.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -79.93 -44.97 19.38 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-O 121.578 0.704 . . . . 0.0 109.586 178.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.412 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 90.9 mmm -66.6 -44.22 82.69 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 114.866 -1.061 . . . . 0.0 112.653 -176.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.658 ' SD ' ' HA ' ' A' ' 85' ' ' ILE . 28.3 ttt . . . . . 0 C--N 1.317 -0.848 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -177.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 22.4 tptm . . . . . 0 N--CA 1.448 -0.546 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -60.99 -40.52 93.8 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.598 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.61 -49.75 69.86 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.801 -179.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.402 ' O ' HG12 ' B' ' 89' ' ' ILE . 64.8 m95 -59.71 -39.74 85.63 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.92 177.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -53.63 -59.78 4.16 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 122.004 0.907 . . . . 0.0 109.262 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -62.37 -38.0 87.87 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.158 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.08 -51.8 66.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.448 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.402 HG12 ' O ' ' B' ' 85' ' ' TRP . 26.9 pt -66.12 -34.24 68.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.736 -0.386 . . . . 0.0 111.789 -177.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -59.33 -43.89 92.67 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.139 0.495 . . . . 0.0 110.285 175.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.426 ' HG2' ' OE2' ' A' ' 114' ' ' GLU . 5.6 tppp? -75.02 -45.44 41.74 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.312 -178.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.13 -41.62 97.14 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -174.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp . . . . . 0 N--CA 1.474 0.768 0 CA-C-O 121.282 0.563 . . . . 0.0 110.389 178.541 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.497 HD23 HG12 ' A' ' 9' ' ' ILE . 6.0 tp . . . . . 0 N--CA 1.429 -1.52 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 16.7 p -74.64 154.18 38.62 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.515 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.7 mp0 -53.33 -45.23 68.99 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.546 0.738 . . . . 0.0 111.331 -175.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -66.3 -34.32 77.73 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.059 0.457 . . . . 0.0 110.685 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 8.8 tp-100 -72.23 -36.17 69.05 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.497 HG12 HD23 ' A' ' 4' ' ' LEU . 62.7 mt -66.64 -34.59 71.07 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.852 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.667 175.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.61 98.91 Favored 'General case' 0 C--O 1.267 2.016 0 C-N-CA 123.128 0.571 . . . . 0.0 110.587 174.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 8' ' ' GLN . 42.6 mm-40 -55.64 -49.06 73.87 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 174.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -68.63 -25.9 65.07 Favored 'General case' 0 C--O 1.187 -2.224 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.311 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 32.9 mmtp -56.48 -56.89 15.59 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 175.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -71.15 -40.77 71.16 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.786 -177.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.13 -30.96 71.93 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.323 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -68.08 -44.48 76.19 Favored 'General case' 0 C--O 1.204 -1.315 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.6 m -63.35 -25.68 68.41 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 120.969 0.414 . . . . 0.0 111.509 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -67.17 -36.99 82.98 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.479 ' CD2' HG21 ' A' ' 35' ' ' VAL . 26.0 m-85 -88.17 -38.41 15.34 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.573 -179.048 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -78.2 99.39 6.21 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 176.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -77.93 -5.23 50.42 Favored 'General case' 0 C--N 1.287 -2.143 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.069 -173.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.639 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 4.1 m-20 -116.98 -13.72 10.63 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.51 53.98 25.49 Favored Glycine 0 CA--C 1.524 0.618 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.881 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.639 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 3.6 m-20 -110.66 -17.79 13.31 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 117.233 0.516 . . . . 0.0 110.241 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.38 21.08 39.09 Favored Glycine 0 N--CA 1.439 -1.165 0 N-CA-C 109.299 -1.521 . . . . 0.0 109.299 -173.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.3 p -146.7 130.98 17.49 Favored 'General case' 0 C--O 1.252 1.229 0 C-N-CA 123.87 0.868 . . . . 0.0 109.613 -178.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 75.1 mt -113.35 121.46 65.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.54 ' OG1' ' HB3' ' A' ' 30' ' ' LYS . 17.9 p -93.83 175.51 6.7 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.282 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.3 p -66.78 -26.58 67.03 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-O 121.316 0.579 . . . . 0.0 109.687 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.54 ' HB3' ' OG1' ' A' ' 28' ' ' THR . 35.4 tttm -49.56 -59.31 3.89 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.401 1.48 . . . . 0.0 109.107 171.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -71.61 -35.77 70.58 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.387 -174.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.5 mt -58.21 -52.04 67.23 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.58 0.55 . . . . 0.0 109.753 175.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.85 -30.13 76.52 Favored Glycine 0 C--O 1.216 -1.0 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.243 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.4 m -59.74 -53.37 58.75 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-O 120.897 0.38 . . . . 0.0 110.624 177.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.482 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 34.2 m -70.28 -34.32 58.02 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.369 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.93 -178.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.472 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 49.6 mtt -68.92 -34.94 76.2 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.969 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.0 ttp85 -60.31 -41.9 94.43 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -64.79 -32.3 73.93 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.741 176.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 90.4 mt -84.36 -5.43 59.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.422 -178.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.15 25.46 37.04 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 116.391 -0.368 . . . . 0.0 113.508 178.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.404 ' C ' HD22 ' A' ' 42' ' ' ASN . 9.4 tt0 -125.59 133.94 52.1 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.404 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -120.65 83.65 35.61 Favored Pre-proline 0 C--N 1.301 -1.507 0 O-C-N 122.226 -0.297 . . . . 0.0 110.513 176.839 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.472 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 6.1 Cg_exo -82.64 154.34 15.62 Favored 'Trans proline' 0 C--O 1.24 0.616 0 C-N-CA 123.121 2.547 . . . . 0.0 111.251 176.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.9 p -86.19 161.74 18.68 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -46.92 -58.96 3.42 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.894 1.678 . . . . 0.0 112.361 -175.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.49 -29.86 70.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 51' ' ' MET . 8.1 mm-40 -68.94 -45.29 71.14 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.1 mt -62.8 -41.2 99.17 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.616 -1.175 . . . . 0.0 109.323 177.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -56.1 -48.09 76.81 Favored 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 123.504 0.722 . . . . 0.0 111.269 176.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -63.66 -37.44 87.36 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 120.613 0.244 . . . . 0.0 111.016 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.499 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 28.1 mmt -59.59 -48.1 83.0 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.423 HG22 ' HB2' ' A' ' 56' ' ' ASP . 61.1 mt -61.04 -45.28 98.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.153 177.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -60.3 -14.84 20.36 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 125.108 1.363 . . . . 0.0 114.49 -176.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -69.76 -39.29 76.8 Favored 'General case' 0 N--CA 1.408 -2.534 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 177.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.717 HG11 ' HB2' ' A' ' 71' ' ' MET . 18.7 m -110.49 -15.86 9.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.028 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.742 -174.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.423 ' HB2' HG22 ' A' ' 52' ' ' ILE . 29.9 t0 -71.49 104.91 3.4 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -177.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.41 -26.6 24.65 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.173 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.73 -11.93 38.14 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -176.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 59.63 60.7 8.27 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.787 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -108.03 -17.36 14.06 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.81 23.51 38.63 Favored Glycine 0 N--CA 1.426 -1.986 0 N-CA-C 109.207 -1.557 . . . . 0.0 109.207 -172.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 57.3 p -139.14 136.11 34.77 Favored 'General case' 0 C--O 1.27 2.165 0 C-N-CA 122.593 0.357 . . . . 0.0 110.321 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.422 HG13 HG12 ' A' ' 52' ' ' ILE . 54.6 mt -91.7 104.7 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.127 0 N-CA-C 105.003 -2.221 . . . . 0.0 105.003 174.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -82.49 153.4 25.61 Favored 'General case' 0 C--N 1.285 -2.213 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 -176.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -45.08 -52.73 18.82 Favored Pre-proline 0 N--CA 1.487 1.4 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -176.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -49.54 -42.64 41.72 Favored 'Trans proline' 0 C--N 1.367 1.537 0 C-N-CA 122.842 2.361 . . . . 0.0 112.65 175.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -73.47 -34.09 65.19 Favored 'General case' 0 CA--C 1.508 -0.664 0 C-N-CA 122.884 0.473 . . . . 0.0 110.304 -178.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -62.8 -39.5 94.46 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.14 -47.47 79.83 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.858 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.4 m -57.64 -41.52 81.55 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.418 0.687 . . . . 0.0 110.281 178.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.717 ' HB2' HG11 ' A' ' 55' ' ' VAL . 31.5 ttp -57.58 -45.01 85.78 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.204 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 26.3 mmt -77.42 -38.88 48.72 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.508 -177.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.44 -46.48 88.62 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 123.35 0.407 . . . . 0.0 111.137 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 66.2 mtp180 -56.42 -31.64 64.1 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.602 0.715 . . . . 0.0 111.758 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -88.13 -25.81 22.8 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.459 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.2 ttp . . . . . 0 C--N 1.31 -1.136 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.699 -175.525 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.1 -46.23 90.3 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -175.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -67.52 -35.9 79.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.036 0.446 . . . . 0.0 110.882 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.9 mm -73.3 -41.68 57.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-O 121.952 0.882 . . . . 0.0 109.217 -176.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -74.25 -34.09 63.5 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.831 -178.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.17 -46.89 88.65 Favored 'General case' 0 CA--C 1.501 -0.905 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.446 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -56.37 -45.77 80.37 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 113.911 -1.495 . . . . 0.0 110.943 177.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -67.21 -45.84 75.64 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 119.739 -0.784 . . . . 0.0 110.863 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -67.07 -22.56 65.84 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -177.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 88' ' ' ALA . 8.1 p -78.88 -21.65 12.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 C-N-CA 119.771 -0.771 . . . . 0.0 110.067 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -94.47 -39.24 10.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.48 175.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -109.27 92.65 4.13 Favored 'General case' 0 C--O 1.245 0.823 0 CA-C-O 121.8 0.81 . . . . 0.0 109.589 174.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -51.47 9.73 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 114.06 -1.427 . . . . 0.0 111.899 -174.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -85.4 -12.37 52.24 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -171.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.23 55.12 1.75 Allowed Glycine 0 N--CA 1.432 -1.612 0 C-N-CA 119.771 -1.204 . . . . 0.0 110.997 177.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -83.21 -18.38 39.5 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.58 -15.54 40.71 Favored Glycine 0 CA--C 1.501 -0.803 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.595 175.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.622 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 73.0 m-85 -140.04 134.4 31.34 Favored 'General case' 0 N--CA 1.417 -2.079 0 N-CA-C 107.275 -1.379 . . . . 0.0 107.275 -179.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.417 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.0 mt -75.27 135.52 27.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.713 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 177.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.5 m -105.97 139.58 40.29 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -177.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.55 -47.7 80.52 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.613 0.598 . . . . 0.0 112.613 -175.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.6 -43.14 97.77 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.675 -178.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -66.09 -40.86 91.14 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.099 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.511 ' O ' ' HG2' ' A' ' 109' ' ' MET . 7.0 tt -62.59 -39.28 93.22 Favored 'General case' 0 C--O 1.215 -0.75 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.441 ' HG3' HG11 ' A' ' 121' ' ' VAL . 27.8 ttt180 -68.34 -30.37 69.31 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.305 0.574 . . . . 0.0 109.943 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -69.88 -45.04 68.55 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.736 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.585 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.7 p -64.59 -29.23 46.78 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.471 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.511 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 19.3 mmt -59.53 -49.61 77.13 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 177.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 23.0 m -60.09 -34.77 73.92 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 121.001 0.429 . . . . 0.0 110.061 177.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -70.77 -33.49 70.83 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.087 0.555 . . . . 0.0 110.906 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 72.6 mt -81.4 -8.17 59.69 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.335 0.588 . . . . 0.0 110.565 -178.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.36 19.45 30.2 Favored Glycine 0 N--CA 1.432 -1.612 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.996 179.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -98.55 177.02 5.46 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -151.28 48.07 0.83 Allowed 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.928 0.871 . . . . 0.0 109.162 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.413 HD12 ' HG3' ' A' ' 109' ' ' MET . 82.2 mt -76.16 143.99 40.83 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.186 -176.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 44.4 p -78.0 170.61 16.31 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.256 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.459 ' HA ' HG22 ' A' ' 121' ' ' VAL . 3.7 p-10 -70.17 -20.65 63.12 Favored 'General case' 0 C--O 1.206 -1.234 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.907 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -71.39 -45.05 63.78 Favored 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 123.485 0.491 . . . . 0.0 110.28 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -65.24 -45.3 85.18 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.964 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.459 HG22 ' HA ' ' A' ' 118' ' ' ASP . 12.8 m -72.57 -27.89 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.39 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.62 -46.29 79.84 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.664 174.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -64.1 -34.19 77.48 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.556 -177.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 65.2 mtt -57.7 -57.72 11.51 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.179 175.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.5 mm -61.56 -56.43 17.84 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.186 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.857 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 -53.01 -44.06 67.0 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 124.909 1.283 . . . . 0.0 113.285 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -87.06 -7.77 57.75 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.957 -175.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -95.43 -30.79 13.7 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 173.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -66.21 102.37 0.83 Allowed 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 125.772 1.629 . . . . 0.0 109.013 173.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.4 mt -81.76 -44.65 20.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.766 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.941 -174.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -73.73 -11.58 60.44 Favored 'General case' 0 C--O 1.243 0.717 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.43 44.72 20.87 Favored Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.51 -0.853 . . . . 0.0 111.252 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -98.03 -16.18 19.73 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.106 0.479 . . . . 0.0 110.126 -177.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.52 4.27 64.13 Favored Glycine 0 C--O 1.241 0.571 0 C-N-CA 120.463 -0.875 . . . . 0.0 111.107 -177.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.622 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 41.7 mt-30 -137.73 151.61 48.38 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.417 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.3 p -114.7 116.33 52.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 C-N-CA 119.898 -0.721 . . . . 0.0 112.893 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.431 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 27.9 t30 -75.55 157.57 33.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.311 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -50.52 -49.04 56.78 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.359 1.064 . . . . 0.0 110.726 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -64.02 -24.73 67.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.985 -177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -85.1 -42.21 15.01 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -63.25 -44.62 94.65 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.431 178.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.92 -30.19 49.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.68 0.276 . . . . 0.0 111.735 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -71.15 -44.06 66.31 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 121.614 0.721 . . . . 0.0 109.935 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 12.9 tmm? -75.41 -40.0 58.35 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.342 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.8 ttt . . . . . 0 C--N 1.325 -0.491 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -178.607 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . 0.407 ' HD3' ' HA ' ' B' ' 82' ' ' LYS . 56.3 mmtt . . . . . 0 CA--C 1.496 -1.127 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.76 -31.41 72.37 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 123.703 0.627 . . . . 0.0 109.346 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.79 -56.11 9.06 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.592 177.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 49.3 m95 -59.43 -42.05 90.97 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . 0.461 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.7 OUTLIER -52.43 -60.48 3.18 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.339 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -56.13 -47.7 77.65 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.506 -1.679 . . . . 0.0 111.159 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.66 -59.67 4.58 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 123.421 0.688 . . . . 0.0 112.81 -176.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 86.9 mt -54.51 -51.27 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 O-C-N 123.793 0.683 . . . . 0.0 111.839 -174.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . 0.415 ' OE1' ' HE2' ' B' ' 86' ' ' LYS . 49.1 mt-30 -62.66 -44.27 96.69 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.096 -174.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.461 ' HE3' ' HB2' ' B' ' 91' ' ' LYS 0.296 19.4 ptmt -81.62 -19.67 41.33 Favored 'General case' 0 C--O 1.21 -0.998 0 C-N-CA 119.256 -0.978 . . . . 0.0 113.447 179.627 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.37 -38.45 81.41 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.453 -0.779 . . . . 0.0 109.216 173.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? . . . . . 0 CA--C 1.545 0.755 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.601 178.786 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.566 HD23 HG12 ' A' ' 9' ' ' ILE . 14.2 tp . . . . . 0 N--CA 1.43 -1.43 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.606 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 38.2 p -72.67 142.9 48.26 Favored 'General case' 0 N--CA 1.427 -1.6 0 C-N-CA 119.223 -0.991 . . . . 0.0 108.864 176.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -71.58 -18.05 62.26 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 112.98 0.734 . . . . 0.0 112.98 -172.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -71.05 -36.52 72.34 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.606 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 6.8 mm100 -70.11 -39.89 75.22 Favored 'General case' 0 C--O 1.196 -1.743 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 177.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.566 HG12 HD23 ' A' ' 4' ' ' LEU . 32.0 mt -59.93 -39.11 79.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.039 176.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.88 -47.26 85.8 Favored 'General case' 0 C--O 1.246 0.914 0 C-N-CA 123.308 0.643 . . . . 0.0 111.064 176.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -63.46 -42.09 98.61 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.801 178.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.56 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 14.9 m-30 -65.37 -34.72 78.97 Favored 'General case' 0 C--O 1.187 -2.212 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.085 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 97.3 mttt -57.03 -43.45 81.89 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.245 0.341 . . . . 0.0 110.89 174.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -59.68 -61.15 2.83 Favored 'General case' 0 C--O 1.258 1.509 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.576 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.64 -26.56 67.86 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.797 -177.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.56 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 30.9 t80 -61.37 -47.6 85.11 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 123.332 0.653 . . . . 0.0 110.503 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.1 m -75.28 -16.93 60.4 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.164 0.507 . . . . 0.0 110.977 178.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.34 -36.64 79.56 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 172.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -84.25 -41.79 16.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.025 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -80.74 99.14 8.07 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -73.6 -1.68 19.8 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -116.75 -14.38 10.77 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 117.996 -1.482 . . . . 0.0 112.014 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.53 28.34 33.02 Favored Glycine 0 C--N 1.309 -0.929 0 C-N-CA 120.28 -0.962 . . . . 0.0 112.637 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -101.2 -17.44 16.62 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.197 0.523 . . . . 0.0 109.788 178.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.58 20.45 76.64 Favored Glycine 0 N--CA 1.437 -1.262 0 CA-C-N 115.537 -0.756 . . . . 0.0 114.733 176.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.6 p -132.04 128.69 38.82 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 171.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.7 mt -104.31 115.75 46.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.846 0 O-C-N 121.873 -0.517 . . . . 0.0 109.731 -174.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -83.61 173.35 11.48 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.043 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.1 p -61.87 -43.05 99.64 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 120.864 0.364 . . . . 0.0 111.022 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -64.91 -35.08 79.99 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.656 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.77 -45.35 68.23 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.083 177.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.9 mt -54.59 -55.72 26.47 Favored 'General case' 0 C--O 1.201 -1.477 0 O-C-N 124.133 0.895 . . . . 0.0 110.723 177.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.25 -31.69 77.96 Favored Glycine 0 CA--C 1.522 0.508 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.486 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.3 m -70.95 -48.77 51.62 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 117.285 0.542 . . . . 0.0 110.686 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.4 m -68.39 -35.11 69.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.637 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.238 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.422 ' HB3' ' HB3' ' A' ' 41' ' ' GLN . 64.5 mtt -65.82 -33.03 74.92 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.149 177.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -62.67 -41.94 99.35 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -68.23 -20.43 64.82 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.706 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.457 ' C ' ' HD2' ' B' ' 91' ' ' LYS . 4.3 mm? -101.0 13.85 33.87 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.048 0.452 . . . . 0.0 112.152 177.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.97 26.98 61.15 Favored Glycine 0 C--O 1.241 0.575 0 N-CA-C 114.564 0.586 . . . . 0.0 114.564 173.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.422 ' HB3' ' HB3' ' A' ' 36' ' ' MET . 10.4 tt0 -127.07 124.41 39.19 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -179.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -119.27 78.01 18.22 Favored Pre-proline 0 C--N 1.298 -1.639 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.475 ' HG2' HD21 ' A' ' 48' ' ' LEU . 38.9 Cg_endo -89.31 160.09 5.59 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 122.29 1.993 . . . . 0.0 112.1 -179.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 39.6 p -80.85 159.98 24.9 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.68 -26.59 68.45 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 120.687 0.28 . . . . 0.0 110.656 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.68 -46.92 85.95 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.105 0.479 . . . . 0.0 110.037 175.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -66.6 -35.02 79.18 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.331 178.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.475 HD21 ' HG2' ' A' ' 43' ' ' PRO . 97.1 mt -66.01 -49.87 66.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.983 177.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -58.43 -43.68 88.81 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 122.959 0.503 . . . . 0.0 110.789 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -65.32 -40.77 94.14 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.083 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.8 tpt -62.27 -42.34 99.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.426 0.631 . . . . 0.0 109.582 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 48' ' ' LEU . 79.5 mt -62.21 -48.98 85.88 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.922 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.913 177.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -52.5 -37.09 56.63 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -174.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -66.43 -28.33 68.52 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.09 -1.044 . . . . 0.0 111.637 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.587 HG11 ' HB2' ' A' ' 71' ' ' MET . 7.8 m -101.58 -20.84 5.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.565 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.407 ' HB2' HG22 ' A' ' 52' ' ' ILE . 31.8 t0 -72.59 111.81 8.09 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 123.904 0.882 . . . . 0.0 111.182 -174.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.87 -16.05 37.22 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.604 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -98.19 -12.42 21.71 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 -177.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.11 31.91 62.42 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -173.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.3 p-10 -98.31 -5.42 32.97 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -172.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.58 23.55 39.2 Favored Glycine 0 N--CA 1.44 -1.05 0 C-N-CA 120.087 -1.054 . . . . 0.0 112.458 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.24 139.95 30.46 Favored 'General case' 0 C--O 1.253 1.279 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 178.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 65.2 mt -92.66 111.75 24.95 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -85.41 166.11 16.66 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.438 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 70.7 t80 -56.17 -53.63 61.47 Favored Pre-proline 0 CA--C 1.554 1.127 0 O-C-N 123.425 0.453 . . . . 0.0 112.114 179.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -51.94 -37.35 66.99 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.927 2.418 . . . . 0.0 112.383 175.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -74.55 -33.55 62.75 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.458 0.647 . . . . 0.0 110.3 -177.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -68.21 -36.8 80.1 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 87.3 mt -61.73 -47.04 87.05 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.396 175.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.8 m -56.24 -47.02 79.33 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 123.764 0.665 . . . . 0.0 110.827 177.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.587 ' HB2' HG11 ' A' ' 55' ' ' VAL . 28.3 ttp -57.58 -42.25 82.76 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 123.205 0.602 . . . . 0.0 111.551 179.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 25.1 mmt -75.28 -44.92 43.11 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.434 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.26 77.48 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.927 0.394 . . . . 0.0 110.227 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -63.87 -46.49 84.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.582 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -62.24 -51.74 66.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.394 -175.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.0 ttm . . . . . 0 C--N 1.31 -1.13 0 C-N-CA 125.169 1.388 . . . . 0.0 112.528 -177.892 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 . . . . . 0 C--O 1.209 -1.063 0 N-CA-C 110.937 -0.023 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -70.25 -56.39 6.89 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 116.891 -0.14 . . . . 0.0 111.053 -172.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -63.61 -28.75 70.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.806 0.813 . . . . 0.0 109.878 178.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.5 mm -70.96 -52.74 25.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-N 114.464 -1.243 . . . . 0.0 109.646 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 35.4 ttm180 -71.31 -35.83 71.39 Favored 'General case' 0 C--O 1.204 -1.304 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.13 -176.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -58.26 -37.59 75.24 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 123.257 0.348 . . . . 0.0 111.502 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -70.25 -39.23 75.15 Favored 'General case' 0 C--O 1.211 -0.923 0 O-C-N 123.484 0.49 . . . . 0.0 110.849 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -71.52 -45.39 62.52 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.457 0.646 . . . . 0.0 109.899 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -64.3 -28.3 69.62 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 125.824 1.65 . . . . 0.0 111.974 -176.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 88' ' ' ALA . 8.4 p -77.81 -22.61 13.9 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.877 -179.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -89.3 -56.81 3.12 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 174.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 97' ' ' ASN . 16.2 t0 -91.4 80.95 5.45 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 122.136 0.97 . . . . 0.0 109.159 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.614 ' HD2' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -78.53 -30.17 46.88 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.51 -1.223 . . . . 0.0 113.572 -175.688 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.8 -13.49 59.38 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.516 0.674 . . . . 0.0 110.612 -178.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.62 76.16 0.8 Allowed Glycine 0 N--CA 1.438 -1.202 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.01 177.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.402 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 35.5 m-80 -110.72 -19.25 12.92 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.199 0.523 . . . . 0.0 109.854 178.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.62 0.98 87.78 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.91 176.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -141.31 145.44 35.48 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -178.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.48 ' HB ' HG13 ' A' ' 136' ' ' VAL . 1.8 mt -105.5 113.54 42.68 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 174.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.6 m -96.46 156.58 16.28 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.88 -39.95 96.04 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 117.748 0.249 . . . . 0.0 111.04 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.51 -44.44 96.01 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 123.399 0.437 . . . . 0.0 110.569 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -65.39 -49.74 68.15 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.277 177.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.462 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.3 tm? -60.79 -40.57 93.14 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 115.305 -0.862 . . . . 0.0 108.746 -174.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.451 ' HB2' HG21 ' A' ' 121' ' ' VAL . 0.7 OUTLIER -59.47 -47.14 86.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 176.25 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -55.49 -52.73 62.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.725 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.708 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.8 p -66.2 -37.63 80.16 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.553 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.358 -177.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.9 mmt -60.69 -41.32 94.94 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.7 m -58.82 -41.31 86.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 175.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -74.49 -24.02 58.95 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.443 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.708 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 84.1 mt -87.61 -19.62 27.53 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.097 0.475 . . . . 0.0 110.098 -178.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 83.19 35.05 19.09 Favored Glycine 0 N--CA 1.43 -1.745 0 C-N-CA 120.892 -0.671 . . . . 0.0 111.543 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -98.83 132.95 43.79 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -84.5 46.22 1.21 Allowed 'General case' 0 C--N 1.292 -1.935 0 C-N-CA 123.473 0.709 . . . . 0.0 110.951 -176.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.419 HD12 ' HG3' ' A' ' 109' ' ' MET . 38.2 mt -86.2 129.52 34.82 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.7 p -79.01 168.44 19.68 Favored 'General case' 0 C--N 1.297 -1.704 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.479 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.51 -50.73 71.54 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -176.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.413 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 1.4 mp0 -60.38 -32.87 71.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.486 0.66 . . . . 0.0 109.719 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -71.52 -43.42 66.49 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.873 -178.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.5 m -68.98 -32.55 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 177.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -67.23 -45.57 76.35 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.529 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -72.06 -32.59 67.22 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.687 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.5 tpp -53.28 -49.22 67.4 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 172.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.0 mm -67.15 -48.33 79.01 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.208 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.531 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -57.67 -33.75 68.67 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.702 0.801 . . . . 0.0 112.259 -175.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -82.76 -23.82 33.78 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.163 0.506 . . . . 0.0 111.189 -178.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -87.98 -24.05 23.65 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.668 0.746 . . . . 0.0 109.522 177.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.482 ' OD2' ' HA2' ' A' ' 132' ' ' GLY . 5.0 t70 -69.96 99.72 1.47 Allowed 'General case' 0 C--N 1.309 -1.152 0 C-N-CA 125.825 1.65 . . . . 0.0 109.763 175.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.6 mt -82.33 -47.76 18.73 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -73.84 -10.68 59.91 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 121.203 0.525 . . . . 0.0 110.997 -176.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.482 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 72.56 52.21 10.6 Favored Glycine 0 N--CA 1.437 -1.286 0 N-CA-C 110.282 -1.127 . . . . 0.0 110.282 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -106.46 -17.37 14.29 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -177.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.64 -9.37 52.3 Favored Glycine 0 N--CA 1.437 -1.251 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.245 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -133.3 137.3 45.92 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 -178.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.48 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.3 p -88.14 116.92 30.87 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 CA-C-O 121.589 0.709 . . . . 0.0 110.469 177.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -84.5 159.58 20.7 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 114.832 -1.077 . . . . 0.0 109.819 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.494 ' O ' HG13 ' A' ' 142' ' ' VAL . 77.0 t80 -54.85 -46.74 74.71 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 123.858 0.863 . . . . 0.0 111.328 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.2 -22.34 65.84 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -87.77 -43.3 11.97 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.57 -35.47 81.09 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.941 -178.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 138' ' ' TYR . 32.6 m -58.38 -35.89 56.07 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.924 0 CA-C-O 120.933 0.397 . . . . 0.0 110.908 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -75.43 -21.05 58.48 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.41 -178.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 92.4 mmm -76.98 -35.42 57.2 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 90.6 mmm . . . . . 0 N--CA 1.427 -1.619 0 CA-C-N 113.455 -1.702 . . . . 0.0 110.362 177.627 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . 0.522 ' O ' ' HG3' ' B' ' 86' ' ' LYS . 87.4 tttt . . . . . 0 C--O 1.225 -0.209 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -59.8 -50.93 71.9 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 176.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.46 -41.81 98.62 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 113.468 -1.696 . . . . 0.0 111.303 177.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.401 ' O ' HG12 ' B' ' 89' ' ' ILE . 74.1 m95 -58.02 -36.43 72.69 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 177.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' B' ' 82' ' ' LYS . 89.1 mttt -52.6 -34.88 52.84 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.483 0.658 . . . . 0.0 110.171 177.087 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -85.02 -54.28 4.75 Favored 'General case' 0 C--O 1.205 -1.283 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.891 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.0 -51.63 51.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.904 0.882 . . . . 0.0 112.748 -176.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.44 HD12 ' HB1' ' A' ' 88' ' ' ALA . 50.4 mm -61.32 -53.35 49.9 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.427 0 CA-C-O 121.543 0.687 . . . . 0.0 109.604 -179.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -69.31 -32.43 71.56 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.624 -1.171 . . . . 0.0 112.173 -171.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.457 ' HD2' ' C ' ' A' ' 39' ' ' LEU . 22.3 tptm -67.71 -39.44 84.35 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.373 0.669 . . . . 0.0 109.699 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . 0.446 ' HA ' HD22 ' A' ' 112' ' ' LEU . . . -82.42 -51.45 7.83 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.79 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 45.6 tptt . . . . . 0 N--CA 1.443 -0.817 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.953 -177.057 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.409 ' HB3' HD11 ' A' ' 9' ' ' ILE . 13.3 tp . . . . . 0 N--CA 1.423 -1.811 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.7 p -90.64 157.02 17.7 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 122.848 0.459 . . . . 0.0 111.372 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -51.29 -49.84 60.48 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 -174.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -40.67 95.95 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -176.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -67.27 -44.05 80.3 Favored 'General case' 0 C--O 1.211 -0.931 0 O-C-N 123.52 0.513 . . . . 0.0 110.015 176.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.519 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 78.5 mt -62.52 -42.4 95.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.614 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.41 -35.76 81.12 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-O 121.555 0.693 . . . . 0.0 110.205 178.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -63.27 -49.99 71.92 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.923 178.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.464 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 42.1 m-85 -71.12 -24.0 62.2 Favored 'General case' 0 C--O 1.177 -2.759 0 CA-C-N 114.88 -1.054 . . . . 0.0 112.459 -179.187 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.1 mttt -62.95 -40.92 99.12 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 119.056 0.843 . . . . 0.0 110.023 174.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -58.81 -56.38 22.95 Favored 'General case' 0 C--O 1.25 1.1 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.119 178.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.455 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -72.61 -23.76 60.98 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.281 -176.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.464 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 47.5 t80 -64.84 -44.34 90.13 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 177.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.8 t -75.76 -16.94 60.06 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.864 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.455 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 38.6 tp -72.18 -41.51 66.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.054 174.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -80.41 -40.45 26.41 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.223 178.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -72.44 99.05 2.38 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.464 ' HE2' HG12 ' A' ' 35' ' ' VAL . 56.3 mttm -83.63 1.73 40.89 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -174.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.578 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 10.4 m-20 -105.68 -13.9 15.42 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.533 179.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.92 34.52 55.77 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.85 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.578 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 2.6 p30 -113.29 -16.88 12.44 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -178.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.73 33.6 33.6 Favored Glycine 0 C--N 1.311 -0.809 0 N-CA-C 114.999 0.76 . . . . 0.0 114.999 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.7 p -149.28 129.04 13.27 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 171.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 60.0 mt -99.18 120.19 48.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-O 121.298 0.571 . . . . 0.0 112.074 -170.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.0 p -93.45 175.18 6.85 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.993 178.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 46.2 p -67.58 -25.52 65.82 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.493 0.664 . . . . 0.0 109.734 176.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -57.89 -57.05 14.48 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.014 175.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -65.11 -40.73 94.94 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.373 -177.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.7 -52.55 64.99 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 123.488 0.492 . . . . 0.0 110.547 175.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.79 -31.05 78.59 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.312 -0.947 . . . . 0.0 112.798 -178.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.0 m -72.74 -43.22 63.19 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 117.467 0.634 . . . . 0.0 111.226 178.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.616 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 35.0 m -67.43 -36.06 75.31 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.422 176.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.47 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 66.2 mtt -67.48 -35.09 78.49 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.187 177.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -61.1 -38.72 87.28 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.3 t -72.02 -28.3 63.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.809 177.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 80.4 mt -78.91 -20.15 50.09 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.881 0.372 . . . . 0.0 110.505 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.37 32.46 7.36 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 121.373 -0.442 . . . . 0.0 112.27 179.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.449 ' C ' HD22 ' A' ' 42' ' ' ASN . 36.1 tt0 -145.18 139.53 27.3 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.449 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -126.25 80.03 69.21 Favored Pre-proline 0 C--N 1.3 -1.573 0 O-C-N 121.773 -0.579 . . . . 0.0 112.403 -179.058 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.47 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 21.9 Cg_exo -69.82 149.43 66.53 Favored 'Trans proline' 0 C--O 1.242 0.705 0 C-N-CA 121.82 1.68 . . . . 0.0 109.447 173.066 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.1 p -78.95 162.53 25.92 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -174.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -44.49 -56.44 4.29 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 126.162 1.785 . . . . 0.0 113.657 -174.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.95 -34.52 76.74 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -175.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -60.78 -45.47 94.23 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.434 ' O ' HG13 ' A' ' 52' ' ' ILE . 96.7 mt -60.83 -43.19 98.59 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.991 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -73.55 -31.78 63.84 Favored 'General case' 0 N--CA 1.44 -0.927 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.448 -178.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.501 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 31.2 t70 -67.27 -40.06 86.12 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 119.719 -0.792 . . . . 0.0 109.577 175.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.8 tpt -59.37 -37.2 77.3 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.368 175.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 48' ' ' LEU . 45.5 mt -66.41 -50.93 63.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.725 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.772 174.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -59.81 -23.12 63.07 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 124.016 0.926 . . . . 0.0 112.724 -173.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 17.0 mm-40 -62.0 -36.94 83.02 Favored 'General case' 0 N--CA 1.396 -3.143 0 C-N-CA 124.479 1.112 . . . . 0.0 111.164 175.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.544 HG11 ' SD ' ' A' ' 71' ' ' MET . 28.9 m -109.02 -14.41 10.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.761 0.315 . . . . 0.0 111.383 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -72.61 114.14 10.42 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.72 -18.91 30.02 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.964 -177.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -97.12 -12.37 23.21 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.57 37.06 88.03 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 -174.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.0 p-10 -101.49 -7.65 22.65 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.36 18.37 28.75 Favored Glycine 0 N--CA 1.436 -1.324 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.937 173.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 p -143.64 142.48 31.04 Favored 'General case' 0 C--O 1.253 1.276 0 CA-C-N 116.731 0.265 . . . . 0.0 110.436 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.9 mt -92.19 108.89 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.64 169.7 15.96 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.437 ' CE2' HD11 ' A' ' 69' ' ' LEU . 52.6 t80 -58.59 -55.88 41.32 Favored Pre-proline 0 CA--C 1.554 1.11 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -176.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.01 -37.08 78.3 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.498 2.132 . . . . 0.0 112.117 176.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -70.25 -39.84 74.79 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.009 0.433 . . . . 0.0 110.433 -178.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -66.08 -39.85 90.36 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.437 HD11 ' CE2' ' A' ' 65' ' ' PHE . 83.4 mt -65.35 -45.24 84.95 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.354 177.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 89.1 m -56.96 -44.71 82.87 Favored 'General case' 0 C--O 1.239 0.535 0 O-C-N 123.466 0.479 . . . . 0.0 109.976 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.544 ' SD ' HG11 ' A' ' 55' ' ' VAL . 32.5 ttp -58.9 -49.13 78.95 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.879 177.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.5 mmt -62.52 -43.84 97.84 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.73 -24.69 66.97 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.087 0.47 . . . . 0.0 111.476 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.9 mtp180 -82.77 -41.54 19.05 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.386 0.613 . . . . 0.0 109.497 175.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -67.99 -28.71 67.67 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.705 -1.134 . . . . 0.0 111.623 -172.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 73.8 mtm . . . . . 0 C--N 1.304 -1.391 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.138 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 121.526 0.679 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.55 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 1.6 mp0 -70.23 -33.25 71.43 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.717 178.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -64.02 -46.66 83.51 Favored 'General case' 0 CA--C 1.492 -1.266 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 6.9 mm -64.73 -35.77 75.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 114.759 -1.11 . . . . 0.0 109.311 -176.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -64.14 -49.76 70.89 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.444 175.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' A' ' 83' ' ' GLU . 40.4 mm-40 -64.41 -36.15 83.22 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.849 0.356 . . . . 0.0 111.83 -176.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.2 -28.06 67.77 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.583 177.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -80.51 -49.55 11.22 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.594 0.712 . . . . 0.0 109.097 176.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -53.94 -30.91 48.58 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 126.379 1.872 . . . . 0.0 112.681 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.441 HG21 ' O ' ' B' ' 92' ' ' ALA . 14.2 p -70.8 -29.39 37.51 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.641 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -86.24 -49.47 7.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 176.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -88.44 79.33 7.7 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.975 179.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HE2' ' O ' ' A' ' 91' ' ' VAL . 70.7 mmtt -75.53 -30.55 59.81 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.621 -177.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -85.37 -12.48 52.07 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -177.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.81 51.6 6.29 Favored Glycine 0 CA--C 1.502 -0.733 0 C-N-CA 120.77 -0.729 . . . . 0.0 111.678 177.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.418 HD22 ' N ' ' A' ' 97' ' ' ASN . 0.9 OUTLIER -90.31 -17.96 26.43 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 123.073 0.549 . . . . 0.0 110.053 -179.423 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.15 9.56 79.89 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.456 178.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 39.7 p90 -157.28 156.96 33.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.532 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.0 mt -105.21 134.88 45.44 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.0 t -107.59 151.01 26.19 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 177.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.12 -55.87 29.5 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -175.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.0 -26.94 68.5 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.137 0.494 . . . . 0.0 110.965 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.95 -40.49 65.35 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.515 177.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.492 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.4 tt -63.56 -39.43 94.38 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.453 ' O ' ' HD2' ' A' ' 106' ' ' ARG . 4.2 tmm_? -66.76 -38.49 86.7 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -59.73 -48.75 80.45 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.048 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.609 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.8 p -65.02 -33.42 63.62 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.298 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.099 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.519 ' HG3' HD12 ' A' ' 116' ' ' LEU . 21.7 mmt -59.72 -45.51 91.96 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-O 120.751 0.31 . . . . 0.0 111.569 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 23.7 m -64.69 -29.75 70.75 Favored 'General case' 0 CA--C 1.563 1.459 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.214 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.73 -24.35 41.68 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.105 0.479 . . . . 0.0 111.091 177.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 77.3 mt -89.17 -19.95 24.84 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.722 0.409 . . . . 0.0 111.01 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.27 24.97 9.79 Favored Glycine 0 C--N 1.308 -1.014 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.905 -178.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -111.1 154.44 24.27 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 121.412 0.625 . . . . 0.0 109.5 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -124.09 104.68 9.01 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.207 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.519 HD12 ' HG3' ' A' ' 109' ' ' MET . 61.7 mt -124.52 151.75 44.27 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 35.7 p -86.85 169.63 12.38 Favored 'General case' 0 C--N 1.29 -2.012 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.415 ' HA ' HG22 ' A' ' 121' ' ' VAL . 2.2 m-20 -66.18 -35.13 79.66 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.96 -43.69 94.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.047 175.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -65.57 -53.65 38.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.885 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.454 ' O ' HG12 ' A' ' 125' ' ' ILE . 23.1 m -65.36 -36.47 77.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.566 -176.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -69.08 -34.3 74.91 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 120.893 0.378 . . . . 0.0 110.441 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.41 -40.51 77.25 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.4 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 56.2 mtt -56.62 -50.99 70.37 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.701 176.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.2 mm -58.02 -45.52 88.07 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 O-C-N 123.919 0.762 . . . . 0.0 109.484 178.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.6 ttp-105 -58.92 -31.74 68.93 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -176.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' A' ' 128' ' ' ALA . 0.4 OUTLIER -79.4 -32.82 43.07 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 117.974 -1.49 . . . . 0.0 109.931 178.357 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.433 ' N ' ' HG3' ' A' ' 127' ' ' GLU . . . -84.75 -24.76 28.67 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.582 -175.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -73.51 89.53 1.69 Allowed 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 124.117 0.967 . . . . 0.0 108.584 175.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 84.7 mt -82.84 -35.85 12.69 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.926 -174.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -81.31 -9.29 59.78 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.561 0.696 . . . . 0.0 111.296 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.08 49.57 15.82 Favored Glycine 0 CA--C 1.499 -0.908 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.697 175.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -115.47 -16.46 11.38 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-O 121.385 0.612 . . . . 0.0 110.942 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.0 5.35 60.97 Favored Glycine 0 C--N 1.304 -1.205 0 N-CA-C 111.097 -0.801 . . . . 0.0 111.097 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -131.73 125.21 31.43 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.532 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.2 p -94.58 111.28 25.14 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.833 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.357 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -85.85 168.98 13.75 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.431 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.576 ' O ' HG13 ' A' ' 142' ' ' VAL . 92.5 t80 -57.18 -45.77 83.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.103 -176.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.471 ' O ' HG22 ' A' ' 142' ' ' VAL . 10.8 pt-20 -61.91 -27.95 69.18 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.31 0.576 . . . . 0.0 111.678 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HG3' ' HG3' ' A' ' 139' ' ' GLU . 38.4 mt-10 -82.39 -41.02 20.47 Favored 'General case' 0 N--CA 1.414 -2.259 0 CA-C-O 122.126 0.965 . . . . 0.0 108.458 -177.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -60.12 -44.65 94.72 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.74 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.576 HG13 ' O ' ' A' ' 138' ' ' TYR . 19.7 m -56.33 -33.85 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 CA-C-O 121.126 0.489 . . . . 0.0 112.193 -177.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -80.09 -50.9 9.68 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.521 -174.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -24.09 63.09 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.408 -176.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.446 -0.627 0 C-N-CA 120.646 -0.422 . . . . 0.0 112.004 178.903 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 86.2 tttt . . . . . 0 C--O 1.246 0.882 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -71.41 -22.65 61.83 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.11 177.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.57 -44.45 90.67 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.4 ' CZ2' ' HB3' ' A' ' 124' ' ' MET . 52.7 m95 -71.06 -36.06 72.16 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.092 175.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -57.19 -54.08 50.84 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 178.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -59.4 -46.14 89.53 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.573 -1.649 . . . . 0.0 111.104 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.2 -55.84 29.77 Favored 'General case' 0 CA--C 1.503 -0.837 0 O-C-N 123.283 0.364 . . . . 0.0 111.122 -179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.401 ' O ' ' HB2' ' B' ' 93' ' ' LYS . 50.5 mm -60.04 -47.3 92.37 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.711 0 O-C-N 123.524 0.515 . . . . 0.0 110.227 -178.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -54.77 -51.98 64.0 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 123.239 0.616 . . . . 0.0 112.141 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.437 ' HA ' HD22 ' A' ' 39' ' ' LEU . 19.8 tptm -69.84 -35.89 75.11 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.097 0.475 . . . . 0.0 111.572 -178.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . 0.441 ' O ' HG21 ' A' ' 91' ' ' VAL . . . -77.82 -34.16 52.13 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.237 -177.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 8.1 tmtm? . . . . . 0 N--CA 1.475 0.798 0 C-N-CA 124.535 1.134 . . . . 0.0 109.362 -178.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.553 ' HG ' ' HB2' ' A' ' 8' ' ' GLN . 9.1 tp . . . . . 0 N--CA 1.426 -1.635 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.454 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 71.4 p -84.44 159.2 20.83 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 119.519 -0.872 . . . . 0.0 109.591 177.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.61 -30.76 71.59 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 111.946 0.351 . . . . 0.0 111.946 -175.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.449 ' CD ' ' H ' ' A' ' 7' ' ' GLU . 1.3 mp0 -57.54 -46.11 84.28 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 177.191 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.553 ' HB2' ' HG ' ' A' ' 4' ' ' LEU . 60.3 mm-40 -65.75 -51.72 56.92 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.408 -179.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.443 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 78.8 mt -57.83 -36.99 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.73 -176.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' ' 13' ' ' LYS . . . -67.26 -40.84 86.26 Favored 'General case' 0 C--O 1.254 1.29 0 CA-C-O 121.594 0.711 . . . . 0.0 110.6 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -64.64 -40.81 96.1 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.375 -0.83 . . . . 0.0 108.995 176.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.406 ' CE2' HD21 ' A' ' 4' ' ' LEU . 36.4 m-85 -60.8 -38.16 84.42 Favored 'General case' 0 C--O 1.162 -3.516 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.307 174.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 10' ' ' ALA . 32.8 mmtp -52.46 -56.47 14.85 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-N 118.318 0.508 . . . . 0.0 111.155 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -64.85 -51.27 62.99 Favored 'General case' 0 C--O 1.25 1.113 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.18 -37.55 87.87 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.996 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -59.8 -42.63 93.85 Favored 'General case' 0 C--O 1.206 -1.205 0 C-N-CA 123.489 0.716 . . . . 0.0 110.272 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.8 m -68.32 -23.69 64.75 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 123.516 0.51 . . . . 0.0 110.742 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.7 tt -73.27 -31.25 63.96 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 121.365 0.602 . . . . 0.0 109.441 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -87.71 -33.04 18.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.475 179.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -79.52 90.61 5.1 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -64.47 -47.06 80.39 Favored 'General case' 0 N--CA 1.428 -1.546 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 -170.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.429 ' OD2' ' HB3' ' A' ' 24' ' ' ASP . 6.7 p-10 -83.2 -13.23 55.84 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.161 -178.112 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.64 58.5 6.35 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 116.008 -0.542 . . . . 0.0 113.145 177.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.429 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 4.8 p-10 -113.62 -15.91 12.43 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 120.991 0.424 . . . . 0.0 110.064 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.33 10.49 38.76 Favored Glycine 0 N--CA 1.43 -1.732 0 CA-C-N 115.962 -0.563 . . . . 0.0 113.955 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 71.2 p -136.75 160.53 38.58 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 118.02 0.91 . . . . 0.0 108.987 175.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.0 mt -120.96 120.4 62.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.152 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.6 p -95.13 175.41 6.63 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.616 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -59.2 -42.75 91.66 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 123.605 0.762 . . . . 0.0 110.606 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -58.73 -44.76 90.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.888 178.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -67.48 -38.69 84.76 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.772 -179.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.23 -46.71 89.27 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.146 176.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.4 -25.19 75.71 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.443 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.9 m -66.71 -54.55 21.77 Favored 'General case' 0 C--O 1.251 1.162 0 CA-C-O 121.31 0.576 . . . . 0.0 109.633 176.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 28.2 m -67.34 -36.13 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.145 -178.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.411 ' HB3' ' O ' ' A' ' 41' ' ' GLN . 49.7 mtt -66.48 -44.4 82.79 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 177.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -59.46 -36.38 75.86 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.0 t -67.62 -14.0 62.56 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.005 179.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 59.6 mt -103.2 -11.57 17.92 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.327 177.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.09 -7.07 32.7 Favored Glycine 0 C--N 1.311 -0.851 0 C-N-CA 120.091 -1.052 . . . . 0.0 114.122 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.411 ' O ' ' HB3' ' A' ' 36' ' ' MET . 0.0 OUTLIER -107.56 131.3 54.5 Favored 'General case' 0 CA--C 1.483 -1.633 0 CA-C-N 118.013 0.907 . . . . 0.0 110.724 177.739 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.34 3.5 p30 -135.0 71.69 68.9 Favored Pre-proline 0 C--N 1.284 -2.28 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 173.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.87 157.19 25.11 Favored 'Trans proline' 0 C--N 1.357 1.016 0 C-N-CA 123.276 2.651 . . . . 0.0 111.472 173.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.5 p -78.17 165.18 24.26 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.425 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.84 -40.83 70.02 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 123.541 0.736 . . . . 0.0 112.04 -179.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.68 -43.75 93.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.188 0.518 . . . . 0.0 110.958 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -64.16 -42.66 96.65 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.544 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 87.7 mt -70.41 -38.59 74.64 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.306 -179.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -64.26 -40.49 96.09 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 123.151 0.58 . . . . 0.0 109.603 177.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.59 -35.56 78.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.76 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.507 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 66.5 mmm -74.38 -33.62 63.1 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.822 177.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.5 mt -66.97 -40.81 86.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 121.371 0.605 . . . . 0.0 109.481 175.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.423 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.9 t30 -63.66 -12.46 34.09 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.254 -178.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.507 ' HB2' ' O ' ' A' ' 51' ' ' MET . 12.2 mm-40 -67.21 -23.54 65.75 Favored 'General case' 0 N--CA 1.394 -3.268 0 C-N-CA 123.742 0.817 . . . . 0.0 111.354 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.541 ' CG1' ' HB2' ' A' ' 71' ' ' MET . 17.4 m -119.58 -19.94 5.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.973 174.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.423 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 11.3 t70 -78.46 82.28 4.74 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.771 0.796 . . . . 0.0 111.843 -173.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.92 -21.81 26.06 Favored 'General case' 0 C--N 1.299 -1.621 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.434 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -81.78 -11.97 58.76 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.34 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.77 12.54 84.42 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 115.41 0.924 . . . . 0.0 115.41 173.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -80.48 -14.29 58.39 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.962 1.381 . . . . 0.0 110.395 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 79.75 20.34 68.62 Favored Glycine 0 N--CA 1.437 -1.279 0 CA-C-N 115.843 -0.617 . . . . 0.0 113.432 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.97 148.19 39.95 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.2 mt -92.26 116.17 32.82 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 108.758 -0.831 . . . . 0.0 108.758 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.44 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 7.1 t70 -87.14 172.53 9.87 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 174.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.444 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 46.7 t80 -57.13 -51.65 80.07 Favored Pre-proline 0 CA--C 1.555 1.168 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -175.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.44 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 8.7 Cg_endo -51.58 -42.48 55.81 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 122.973 2.448 . . . . 0.0 112.6 175.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.85 -39.63 87.66 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.632 0.729 . . . . 0.0 110.067 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -66.38 -40.66 89.84 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.598 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 78.0 mt -63.73 -37.78 88.66 Favored 'General case' 0 C--O 1.206 -1.196 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.987 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.438 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 86.5 m -59.22 -50.88 72.32 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 123.493 0.496 . . . . 0.0 110.912 178.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.541 ' HB2' ' CG1' ' A' ' 55' ' ' VAL . 34.0 ttp -66.03 -36.65 83.82 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.053 0.454 . . . . 0.0 111.84 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.5 mmt -82.22 -24.87 34.64 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.786 -0.766 . . . . 0.0 112.334 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.71 -29.89 67.39 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 173.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 70' ' ' THR . 99.8 mtt180 -66.24 -29.86 70.19 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.731 0.777 . . . . 0.0 109.529 174.034 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -81.94 -12.14 58.53 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.937 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.9 ttm . . . . . 0 C--N 1.313 -1.007 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.484 -179.195 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.44 -0.94 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.601 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 44.0 mt-10 -62.84 -58.47 7.29 Favored 'General case' 0 CA--C 1.489 -1.377 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.943 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -49.6 -45.36 47.94 Favored 'General case' 0 C--O 1.251 1.156 0 C-N-CA 124.817 1.247 . . . . 0.0 110.376 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.531 HG21 HG12 ' A' ' 142' ' ' VAL . 40.0 mm -66.75 -50.73 63.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 114.416 -1.265 . . . . 0.0 110.426 -177.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -70.66 -27.68 64.22 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.138 -177.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.601 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 51.4 mt-10 -60.08 -44.9 94.44 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 175.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.34 -38.11 81.17 Favored 'General case' 0 C--O 1.21 -1.008 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.831 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.76 -43.6 83.62 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.404 0.621 . . . . 0.0 110.139 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 -66.23 -26.76 67.52 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 124.739 1.216 . . . . 0.0 111.7 -176.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.0 p -83.76 -19.76 9.39 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 C-N-CA 120.308 -0.557 . . . . 0.0 111.287 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -91.3 -49.78 6.17 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 122.037 -0.414 . . . . 0.0 110.012 177.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -84.42 107.38 16.65 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 177.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -73.28 -26.62 61.16 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.342 -172.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -103.81 -14.18 16.14 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.529 0.68 . . . . 0.0 110.789 -176.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.04 45.15 58.14 Favored Glycine 0 N--CA 1.43 -1.725 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -176.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -85.61 -17.83 35.03 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 121.427 0.632 . . . . 0.0 109.644 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 101.45 16.08 25.7 Favored Glycine 0 N--CA 1.434 -1.449 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.515 173.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -146.71 131.39 17.88 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -177.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.475 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.1 mt -100.68 126.93 54.24 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.5 t -107.24 144.72 33.63 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.46 94.21 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.208 0.603 . . . . 0.0 111.782 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.56 89.09 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.093 0.473 . . . . 0.0 110.802 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.531 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 5.0 tp10 -72.15 -45.36 60.8 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.498 178.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.506 ' O ' ' HG2' ' A' ' 109' ' ' MET . 8.5 tt -60.23 -37.81 81.49 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 -176.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.487 ' HB2' HG21 ' A' ' 121' ' ' VAL . 45.8 ttt180 -63.14 -37.15 86.06 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.727 177.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.531 ' HB2' ' O ' ' A' ' 104' ' ' GLU . 56.7 m170 -51.98 -53.51 40.66 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.365 177.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.58 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.3 p -71.02 -30.61 42.01 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.621 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.335 -176.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.506 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.2 mmt -63.6 -47.02 83.16 Favored 'General case' 0 CA--C 1.494 -1.209 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.7 m -62.11 -32.75 73.35 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.406 177.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -73.48 -33.57 64.89 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.216 177.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 84.9 mt -84.65 -20.87 30.62 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.009 0.433 . . . . 0.0 110.986 -176.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 89.48 18.12 53.23 Favored Glycine 0 N--CA 1.431 -1.685 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.1 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -84.58 107.57 16.87 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 176.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -70.3 99.63 1.58 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.4 -177.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 62.9 mt -137.1 149.04 47.09 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -89.86 173.83 8.03 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -66.94 -34.17 77.19 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -61.28 -47.41 86.13 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.519 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -62.68 -48.76 77.91 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.459 -177.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.487 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.2 m -66.96 -33.42 63.27 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 CA-C-O 121.014 0.435 . . . . 0.0 110.9 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -74.35 -37.12 63.59 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.0 0.429 . . . . 0.0 109.971 178.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -61.44 -41.6 97.45 Favored 'General case' 0 C--O 1.248 1.025 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.427 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 62.3 mtt -53.71 -56.83 13.9 Favored 'General case' 0 CA--C 1.504 -0.804 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.752 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.9 mm -57.9 -50.57 77.38 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.724 0 CA-C-N 114.482 -1.236 . . . . 0.0 111.451 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -61.43 -21.67 64.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -83.81 -36.91 23.16 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.795 176.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.86 -31.04 40.41 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 120.904 0.383 . . . . 0.0 110.525 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.38 94.65 0.96 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.208 1.403 . . . . 0.0 109.532 175.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.67 -38.89 15.39 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.921 -176.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -74.76 -10.71 59.77 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.777 -176.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.72 45.63 27.38 Favored Glycine 0 N--CA 1.441 -0.984 0 C-N-CA 120.664 -0.779 . . . . 0.0 111.538 178.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -105.37 -15.94 14.89 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.858 0.837 . . . . 0.0 109.664 -176.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.03 5.04 73.98 Favored Glycine 0 CA--C 1.495 -1.176 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -143.71 125.53 15.16 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.475 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.4 OUTLIER -89.21 128.18 41.44 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.274 0 O-C-N 123.556 0.535 . . . . 0.0 110.131 -179.473 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -91.12 170.97 9.58 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.977 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.624 ' O ' HG13 ' A' ' 142' ' ' VAL . 81.6 t80 -54.34 -44.79 72.41 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -175.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -68.58 -25.53 64.93 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HB2' HG23 ' A' ' 136' ' ' VAL . 51.7 mt-10 -81.27 -39.1 25.79 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 176.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -67.22 -43.03 83.04 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.699 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.624 HG13 ' O ' ' A' ' 138' ' ' TYR . 27.1 m -53.78 -36.52 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -68.83 -42.21 77.5 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.765 -177.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 27.9 ttt -86.5 -30.24 22.13 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.41 -178.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.412 ' SD ' HG21 ' B' ' 89' ' ' ILE . 14.5 tpt . . . . . 0 C--N 1.308 -1.196 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.313 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp . . . . . 0 N--CA 1.449 -0.513 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . 0.436 ' O ' ' HB3' ' B' ' 86' ' ' LYS . 37.1 mt-10 -81.63 -27.43 34.14 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.189 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.8 -50.88 54.51 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.556 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.528 ' O ' HG12 ' B' ' 89' ' ' ILE . 84.5 m95 -63.66 -32.19 73.6 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.487 176.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' B' ' 83' ' ' GLU . 37.8 ttpt -54.09 -58.45 7.27 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 175.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -57.35 -45.54 84.24 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 114.28 -1.327 . . . . 0.0 111.78 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.93 -61.5 2.34 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 124.402 1.064 . . . . 0.0 112.501 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.528 HG12 ' O ' ' B' ' 85' ' ' TRP . 36.7 pt -65.14 -36.26 77.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -174.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -64.33 -55.93 17.91 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.414 ' CG ' ' HB3' ' A' ' 112' ' ' LEU . 3.4 tppp? -68.32 -31.54 71.03 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.645 -174.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.88 -37.34 73.03 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.873 178.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 64.1 tttp . . . . . 0 CA--C 1.55 0.95 0 CA-C-O 121.876 0.846 . . . . 0.0 109.961 177.645 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.7 tp . . . . . 0 N--CA 1.414 -2.238 0 N-CA-C 103.891 -2.633 . . . . 0.0 103.891 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.2 p -68.18 148.02 51.45 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.602 -0.839 . . . . 0.0 109.254 -177.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -61.94 -25.66 67.73 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.0 0.429 . . . . 0.0 110.591 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -64.94 -51.23 62.99 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.034 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -65.52 -35.17 80.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.788 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.532 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 51.5 mt -67.57 -32.31 56.41 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.269 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.125 177.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.59 -40.53 88.94 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 175.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.45 -43.07 97.22 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.063 175.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -73.61 -15.41 61.27 Favored 'General case' 0 C--O 1.169 -3.179 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 68.6 mttm -72.97 -42.99 62.78 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 119.251 0.932 . . . . 0.0 108.636 175.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -62.36 -50.07 73.03 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.51 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.64 -40.74 97.62 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.137 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.445 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 92.8 t80 -60.17 -48.63 80.93 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 123.289 0.636 . . . . 0.0 110.094 178.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 m -69.3 -17.52 63.74 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 123.426 0.453 . . . . 0.0 111.464 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.88 -34.88 78.75 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 174.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.596 ' CD2' HG21 ' A' ' 35' ' ' VAL . 17.1 m-85 -90.31 -44.98 9.34 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.001 177.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -87.27 83.34 7.39 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -71.55 -15.57 62.29 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -170.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.484 ' OD1' ' HB3' ' A' ' 24' ' ' ASP . 4.3 p-10 -97.37 -9.85 26.65 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 118.885 -1.126 . . . . 0.0 110.007 177.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.87 50.58 66.0 Favored Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.403 -0.817 . . . . 0.0 113.373 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.484 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 1.2 p-10 -104.08 -17.3 14.99 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.544 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.54 2.53 50.25 Favored Glycine 0 N--CA 1.436 -1.35 0 C-N-CA 120.022 -1.085 . . . . 0.0 114.513 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 52.9 p -137.31 129.44 29.32 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.606 1.203 . . . . 0.0 109.346 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.1 mt -96.29 122.21 47.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 -174.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -94.84 163.44 13.34 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.039 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 34.1 p -63.55 -30.85 71.91 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.801 0.334 . . . . 0.0 111.5 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -59.93 -46.48 89.25 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.134 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -63.18 -46.87 85.09 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.462 ' HB3' HD22 ' A' ' 48' ' ' LEU . 92.7 mt -54.15 -55.57 26.53 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.21 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.7 -31.56 76.31 Favored Glycine 0 C--N 1.305 -1.165 0 C-N-CA 119.328 -1.415 . . . . 0.0 113.131 -176.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 48.5 m -66.02 -46.73 76.85 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 117.04 0.42 . . . . 0.0 110.569 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.596 HG21 ' CD2' ' A' ' 19' ' ' PHE . 34.1 m -70.02 -37.34 72.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.108 178.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.412 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 1.9 mpp? -64.62 -39.83 94.4 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.528 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.545 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 22.3 ttt180 -66.49 -34.02 76.99 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 121.091 0.472 . . . . 0.0 110.148 178.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.8 m -69.69 -25.68 64.0 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.547 -0.752 . . . . 0.0 109.716 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.6 mt -87.29 -1.62 58.04 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.972 177.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 102.34 -10.0 56.29 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.679 176.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.545 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 60.9 tt0 -95.76 138.85 32.82 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -177.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.443 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -117.95 81.68 16.19 Favored Pre-proline 0 C--N 1.301 -1.543 0 O-C-N 121.609 -0.682 . . . . 0.0 109.822 177.446 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -84.85 149.78 11.05 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 122.293 1.995 . . . . 0.0 111.793 178.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.3 p -90.27 170.28 10.4 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.322 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -55.35 -47.36 75.84 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.447 1.099 . . . . 0.0 110.073 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -45.34 84.13 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.776 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 51' ' ' MET . 42.9 mt-10 -65.61 -44.25 87.09 Favored 'General case' 0 C--O 1.221 -0.431 0 O-C-N 123.655 0.597 . . . . 0.0 111.557 -177.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.462 HD22 ' HB3' ' A' ' 32' ' ' LEU . 88.9 mt -69.02 -39.27 79.37 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.277 -177.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -71.25 -33.74 70.11 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.89 -36.88 84.8 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.413 0.625 . . . . 0.0 109.394 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.497 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 94.8 mmm -67.51 -47.37 70.19 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.222 177.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 58.5 mt -59.59 -44.12 92.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.18 0.514 . . . . 0.0 110.444 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.503 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.1 t30 -55.55 -28.52 55.36 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 114.908 1.448 . . . . 0.0 114.908 -173.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 51' ' ' MET . 9.5 pt-20 -69.04 -27.24 65.48 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 119.198 -1.001 . . . . 0.0 112.591 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.513 HG11 ' HB2' ' A' ' 71' ' ' MET . 34.7 m -101.67 -11.81 8.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.579 0.705 . . . . 0.0 109.794 177.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.503 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 25.9 t70 -87.92 75.7 8.78 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.423 -173.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.6 -20.57 39.52 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.606 0.717 . . . . 0.0 109.798 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -82.38 -6.96 59.61 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.312 178.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 59.54 43.46 97.57 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 115.895 1.118 . . . . 0.0 115.895 172.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -109.64 -1.33 18.17 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 119.252 -0.979 . . . . 0.0 110.721 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 69.34 23.15 76.48 Favored Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.603 -0.726 . . . . 0.0 113.423 176.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -141.29 149.77 41.68 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 52.3 mt -103.87 114.79 44.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.422 ' HB2' ' HD2' ' A' ' 66' ' ' PRO . 1.2 p30 -78.68 163.25 25.6 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 119.724 -0.791 . . . . 0.0 110.261 174.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.5 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 31.8 t80 -54.21 -50.5 84.3 Favored Pre-proline 0 C--N 1.313 -1.017 0 O-C-N 123.913 0.758 . . . . 0.0 110.879 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.5 ' HD3' ' HB3' ' A' ' 65' ' ' PHE . 59.5 Cg_exo -47.2 -51.58 9.21 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 122.233 1.955 . . . . 0.0 112.739 171.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.08 -47.13 81.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.324 0.583 . . . . 0.0 110.468 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.445 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 37.4 t80 -61.56 -42.99 99.65 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.31 -177.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 90.9 mt -63.61 -44.14 94.83 Favored 'General case' 0 CA--C 1.504 -0.804 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.542 177.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.0 m -59.25 -47.72 84.3 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.778 0.674 . . . . 0.0 109.843 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.513 ' HB2' HG11 ' A' ' 55' ' ' VAL . 36.2 ttp -60.96 -41.33 96.13 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.428 179.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 21.3 mmt -69.27 -42.45 75.52 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 178.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.31 -39.63 93.63 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.816 0.341 . . . . 0.0 110.303 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -61.77 -39.59 92.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.927 175.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -80.63 -3.52 50.76 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 122.228 1.013 . . . . 0.0 110.445 -175.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 51.5 ttm . . . . . 0 C--N 1.305 -1.331 0 CA-C-O 121.798 0.809 . . . . 0.0 108.885 177.602 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 . . . . . 0 CA--C 1.532 0.263 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.465 ' O ' ' HB2' ' A' ' 87' ' ' GLU . 51.2 mm-40 -52.48 -62.42 1.65 Allowed 'General case' 0 C--O 1.202 -1.409 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -179.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -48.16 -45.82 33.92 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.228 1.011 . . . . 0.0 111.464 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.401 ' HA ' ' HG2' ' A' ' 145' ' ' MET . 4.5 mm -69.8 -52.42 31.67 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.012 -171.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.4 ttp180 -75.97 -22.27 56.1 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.278 -177.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 6.4 tp10 -64.6 -52.27 58.4 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 176.05 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.418 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -62.6 -37.91 88.1 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 114.484 -1.235 . . . . 0.0 110.231 179.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -65.15 -46.56 80.38 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.457 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -69.73 -27.56 65.06 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.646 0.778 . . . . 0.0 112.752 -175.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.418 HG12 ' O ' ' A' ' 88' ' ' ALA . 13.7 p -72.97 -20.13 18.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 119.464 -0.895 . . . . 0.0 110.438 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -91.5 -60.57 1.85 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 173.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.43 ' CG ' ' H ' ' A' ' 97' ' ' ASN . 14.0 t0 -86.81 82.72 7.73 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 122.689 1.233 . . . . 0.0 109.224 177.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -78.11 -29.64 49.07 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.949 -174.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -85.68 -13.06 49.68 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-O 121.356 0.598 . . . . 0.0 110.329 -174.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.98 63.34 2.31 Favored Glycine 0 N--CA 1.426 -2.013 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 179.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.43 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 38.5 m-80 -92.33 -19.17 22.41 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.55 13.68 79.7 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -166.62 153.49 9.07 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 124.316 1.046 . . . . 0.0 109.587 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.457 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.4 mt -110.94 128.3 67.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 19.1 m -103.53 160.36 14.8 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.09 -45.01 94.13 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 122.256 0.222 . . . . 0.0 111.338 -178.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.44 -43.8 88.91 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 123.75 0.656 . . . . 0.0 110.302 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -57.76 -56.58 20.09 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.094 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.441 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.0 tm? -58.68 -44.65 90.28 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.295 -1.321 . . . . 0.0 108.995 -173.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.514 ' HB2' HG21 ' A' ' 121' ' ' VAL . 27.8 ttp180 -61.0 -48.74 80.41 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.905 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -60.16 -39.48 86.55 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.472 -178.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.572 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 10.0 p -73.32 -34.3 43.29 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.384 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.488 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.593 ' HG3' HD12 ' A' ' 116' ' ' LEU . 23.1 mmt -63.8 -41.87 97.82 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-N 116.741 -0.209 . . . . 0.0 111.415 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.7 m -62.28 -35.73 79.89 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 176.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -68.81 -33.68 74.25 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.435 0.636 . . . . 0.0 110.381 176.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 52.9 mt -82.86 -16.75 46.4 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.331 -176.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.15 34.86 13.38 Favored Glycine 0 N--CA 1.427 -1.932 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.77 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -103.42 140.69 37.13 Favored 'General case' 0 N--CA 1.418 -2.03 0 C-N-CA 119.722 -0.791 . . . . 0.0 109.795 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -81.43 23.9 0.59 Allowed 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 114.51 -1.223 . . . . 0.0 113.035 -173.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.593 HD12 ' HG3' ' A' ' 109' ' ' MET . 13.9 mt -69.01 132.86 47.32 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 120.605 0.241 . . . . 0.0 110.517 -175.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.8 p -80.43 167.25 20.41 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.018 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -64.47 -28.69 69.84 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 176.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -65.18 -55.11 20.47 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.788 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -55.67 -51.4 67.38 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 123.848 0.717 . . . . 0.0 110.884 -177.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.514 HG21 ' HB2' ' A' ' 106' ' ' ARG . 15.2 m -61.22 -37.31 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.354 -177.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -72.51 -44.63 61.95 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.35 0.595 . . . . 0.0 109.709 -178.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.503 ' OE1' ' HD3' ' A' ' 126' ' ' ARG . 4.7 tp10 -67.38 -36.19 80.85 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.253 -176.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.442 ' HE2' ' HB1' ' B' ' 84' ' ' ALA . 52.3 mtt -56.13 -54.91 39.4 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.014 174.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.6 mm -57.74 -48.52 83.34 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.81 0 O-C-N 124.226 0.954 . . . . 0.0 110.42 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.503 ' HD3' ' OE1' ' A' ' 123' ' ' GLU . 57.0 ttt180 -59.42 -37.86 79.14 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 123.743 0.817 . . . . 0.0 112.494 -176.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -81.65 -25.14 35.86 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 178.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.88 -28.88 39.89 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 176.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.12 85.35 4.31 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 114.362 -1.29 . . . . 0.0 108.725 173.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 53.9 mt -77.46 -23.9 14.52 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.966 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.35 -176.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -86.5 -10.79 53.36 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 120.503 -0.479 . . . . 0.0 112.197 -175.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.2 41.08 22.64 Favored Glycine 0 C--N 1.317 -0.507 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.474 175.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -101.59 -16.14 16.84 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.73 0.776 . . . . 0.0 109.63 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 96.89 -11.19 66.19 Favored Glycine 0 N--CA 1.441 -0.98 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.471 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -136.36 131.28 34.04 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -178.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.457 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.5 p -80.73 113.65 20.47 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-O 120.817 0.341 . . . . 0.0 111.761 -177.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -88.46 178.09 6.64 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.506 ' O ' HG13 ' A' ' 142' ' ' VAL . 85.7 t80 -66.76 -39.89 88.04 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -175.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.513 ' O ' HG22 ' A' ' 142' ' ' VAL . 22.5 mm-40 -67.2 -28.82 68.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.321 0.582 . . . . 0.0 110.857 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.11 -33.3 44.48 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.414 0.626 . . . . 0.0 110.367 175.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -75.33 -29.87 60.12 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.831 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 139' ' ' GLU . 31.7 m -60.0 -33.48 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-O 121.247 0.546 . . . . 0.0 110.612 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -71.79 -40.15 69.4 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.729 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 95.9 mmm -69.31 -39.08 78.46 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.172 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.401 ' HG2' ' HA ' ' A' ' 85' ' ' ILE . 15.5 tpt . . . . . 0 C--N 1.315 -0.93 0 CA-C-O 121.62 0.724 . . . . 0.0 110.317 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm . . . . . 0 C--O 1.216 -0.71 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.16 -47.59 79.27 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.442 ' HB1' ' HE2' ' A' ' 124' ' ' MET . . . -55.75 -58.79 6.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.26 -1.337 . . . . 0.0 111.723 -178.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -67.6 -33.0 74.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -56.13 -57.94 10.03 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 175.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -58.44 -40.31 82.23 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.011 -1.45 . . . . 0.0 110.679 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.1 -54.43 44.71 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.803 0.335 . . . . 0.0 111.312 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 80.9 mt -62.78 -38.97 83.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.548 0.69 . . . . 0.0 109.505 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -58.03 -42.91 86.34 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 124.952 1.301 . . . . 0.0 111.548 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -81.0 -42.73 20.7 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.829 -177.085 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.32 -52.34 9.34 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -175.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 18.0 ttpt . . . . . 0 C--N 1.316 -0.851 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -174.37 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.449 ' HB3' HD11 ' A' ' 9' ' ' ILE . 19.6 tp . . . . . 0 N--CA 1.42 -1.929 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.1 p -85.02 145.14 27.85 Favored 'General case' 0 N--CA 1.413 -2.308 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.574 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.441 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.2 mp0 -51.69 -40.24 59.73 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 125.438 1.495 . . . . 0.0 111.969 -176.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.81 -45.36 89.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.889 -178.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.671 ' HA ' HE21 ' A' ' 8' ' ' GLN . 0.0 OUTLIER -65.88 -45.85 80.57 Favored 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 176.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.553 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 74.8 mt -57.11 -44.26 82.88 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.352 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.856 -178.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.55 93.6 Favored 'General case' 0 C--O 1.256 1.427 0 CA-C-O 121.393 0.616 . . . . 0.0 111.44 177.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.38 -40.59 96.97 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.664 0.745 . . . . 0.0 109.135 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -73.79 -18.78 60.92 Favored 'General case' 0 C--O 1.189 -2.087 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.509 -178.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.553 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.6 mttt -65.69 -50.78 63.67 Favored 'General case' 0 CA--C 1.504 -0.819 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -45.34 88.4 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.941 177.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.68 87.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.607 179.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -61.99 -45.57 93.06 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 m -68.58 -18.1 64.26 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.957 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -67.18 -41.9 85.12 Favored 'General case' 0 C--O 1.243 0.739 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 172.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.428 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 79.3 m-85 -81.44 -50.94 8.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.872 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -63.41 101.34 0.31 Allowed 'General case' 0 CA--C 1.502 -0.887 0 O-C-N 124.293 0.996 . . . . 0.0 109.038 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 19' ' ' PHE . 41.7 mmtm -71.94 -9.09 57.87 Favored 'General case' 0 N--CA 1.423 -1.8 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.265 -174.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -107.34 -14.35 14.9 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.55 45.09 90.48 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.516 -0.634 . . . . 0.0 111.516 -176.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -112.74 -15.91 12.88 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 122.621 -0.341 . . . . 0.0 111.59 -175.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.82 16.8 20.75 Favored Glycine 0 N--CA 1.43 -1.708 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.111 179.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 68.0 p -142.37 138.67 31.36 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 117.351 0.575 . . . . 0.0 109.804 173.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 67.8 mt -112.99 114.66 47.61 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 176.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.478 HG22 HG22 ' A' ' 62' ' ' THR . 37.2 p -84.41 174.04 10.41 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.162 -177.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.7 p -61.76 -32.83 73.12 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.613 0.721 . . . . 0.0 109.404 174.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -57.56 -55.05 39.9 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 114.639 -1.164 . . . . 0.0 109.051 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -67.23 -39.39 86.2 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.596 -177.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.2 mt -58.38 -50.6 73.1 Favored 'General case' 0 C--O 1.213 -0.821 0 O-C-N 123.133 0.27 . . . . 0.0 111.482 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.09 -30.76 76.24 Favored Glycine 0 C--O 1.214 -1.112 0 C-N-CA 119.488 -1.339 . . . . 0.0 111.836 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.1 m -64.2 -49.45 71.93 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 120.758 0.314 . . . . 0.0 110.456 176.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.1 m -70.22 -37.54 71.75 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.628 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.688 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtt -65.34 -37.74 87.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.73 -0.214 . . . . 0.0 111.09 178.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -63.92 -33.51 75.87 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.932 0.396 . . . . 0.0 110.078 177.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.8 m -71.01 -30.0 66.11 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.482 177.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -84.64 -19.19 33.3 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 110.29 35.74 2.07 Favored Glycine 0 N--CA 1.442 -0.911 0 C-N-CA 120.978 -0.629 . . . . 0.0 114.475 177.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.562 ' HB2' ' NE2' ' B' ' 90' ' ' GLN . 61.3 tt0 -140.06 132.16 27.98 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 171.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.408 HD22 ' N ' ' A' ' 42' ' ' ASN . 0.7 OUTLIER -116.49 83.81 13.97 Favored Pre-proline 0 C--N 1.289 -2.052 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 175.533 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.493 ' HG2' HD21 ' A' ' 48' ' ' LEU . 9.3 Cg_endo -86.96 156.64 8.59 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.583 2.189 . . . . 0.0 112.415 -179.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.3 t -82.45 158.29 23.3 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mp0 -59.6 -28.87 67.55 Favored 'General case' 0 C--O 1.21 -1.001 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -43.22 82.86 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.063 0.459 . . . . 0.0 110.696 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -69.21 -44.01 72.95 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.814 0.816 . . . . 0.0 109.456 -178.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.493 HD21 ' HG2' ' A' ' 43' ' ' PRO . 87.8 mt -63.72 -40.49 96.88 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.32 -178.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -64.33 -37.85 88.96 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.168 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -59.21 -42.43 90.95 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 123.708 0.63 . . . . 0.0 109.981 179.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.2 tpp -68.36 -52.99 27.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.949 177.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.1 mt -54.76 -49.15 71.06 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.749 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.629 -178.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.421 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 7.8 t30 -58.76 -20.75 52.4 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 123.953 0.901 . . . . 0.0 113.132 -172.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -73.74 -43.02 60.29 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-O 121.214 0.53 . . . . 0.0 110.068 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.678 HG11 ' HB2' ' A' ' 71' ' ' MET . 26.6 m -90.72 -15.41 8.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.896 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.421 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 27.3 t70 -81.57 88.78 6.18 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.681 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.79 -13.16 45.94 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -91.19 -10.33 42.09 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -178.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 74.15 29.02 63.12 Favored Glycine 0 N--CA 1.439 -1.106 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.512 177.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -96.35 -16.48 21.27 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 117.607 0.704 . . . . 0.0 111.784 177.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.69 23.34 64.79 Favored Glycine 0 N--CA 1.441 -1.013 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.7 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.478 HG22 HG22 ' A' ' 28' ' ' THR . 15.2 p -138.42 137.24 37.04 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 54.3 mt -89.61 110.37 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.963 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -175.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -79.89 162.6 24.91 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.494 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 68.3 t80 -52.84 -53.02 59.34 Favored Pre-proline 0 C--N 1.307 -1.252 0 CA-C-O 119.061 -0.495 . . . . 0.0 112.155 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -50.99 -42.23 53.28 Favored 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 122.679 2.253 . . . . 0.0 112.715 174.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -68.48 -35.88 78.17 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.265 0.555 . . . . 0.0 110.287 -179.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -66.29 -39.87 89.67 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 85.8 mt -63.21 -44.12 96.19 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.596 176.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 57.4 m -55.14 -50.18 69.91 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 123.676 0.61 . . . . 0.0 109.809 176.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.678 ' HB2' HG11 ' A' ' 55' ' ' VAL . 31.5 ttp -59.46 -45.32 91.95 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.603 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 31.8 tpp -67.62 -39.88 84.7 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.27 0.557 . . . . 0.0 110.842 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.11 -24.81 61.54 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.36 -178.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -75.63 -31.73 59.97 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.775 0.798 . . . . 0.0 108.947 172.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -74.46 -54.25 7.93 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.335 -174.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 20.9 ptp . . . . . 0 C--N 1.316 -0.871 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.257 -176.933 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 . . . . . 0 CA--C 1.496 -1.133 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -50.86 -37.41 43.2 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -62.16 -46.03 90.76 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.488 0.661 . . . . 0.0 111.49 175.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.466 HG21 ' HA ' ' A' ' 142' ' ' VAL . 10.0 mm -70.61 -42.44 77.97 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.556 -176.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -69.34 -34.47 74.67 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.517 -1.22 . . . . 0.0 111.562 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.35 -48.62 79.0 Favored 'General case' 0 CA--C 1.495 -1.171 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.471 ' O ' ' HD2' ' A' ' 92' ' ' PHE . . . -61.0 -44.85 96.81 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 113.238 -1.801 . . . . 0.0 110.701 177.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -63.06 -47.31 83.5 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.086 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -58.17 -35.05 71.0 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 178.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.4 HG12 ' O ' ' A' ' 88' ' ' ALA . 7.9 p -76.59 -28.28 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.278 -178.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.471 ' HD2' ' O ' ' A' ' 88' ' ' ALA . 73.8 m-85 -86.63 -42.29 13.56 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.885 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -73.59 85.56 1.59 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.941 0.877 . . . . 0.0 109.411 177.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -79.44 -42.7 24.81 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.952 -175.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.22 -13.03 51.2 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.859 -175.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.05 54.57 4.07 Favored Glycine 0 C--N 1.307 -1.075 0 C-N-CA 120.149 -1.024 . . . . 0.0 110.558 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -100.22 -19.96 16.15 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.06 2.03 88.36 Favored Glycine 0 C--O 1.24 0.499 0 N-CA-C 110.24 -1.144 . . . . 0.0 110.24 -177.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.515 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 42.4 m-85 -142.22 130.75 22.53 Favored 'General case' 0 N--CA 1.425 -1.686 0 C-N-CA 126.262 1.825 . . . . 0.0 106.38 -178.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.436 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.0 mt -81.19 126.98 39.91 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.6 t -94.33 150.54 20.18 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.68 -44.88 80.61 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.631 0.253 . . . . 0.0 111.136 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.27 -34.87 78.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.414 0.626 . . . . 0.0 109.643 178.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -67.17 -45.97 75.39 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.057 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.9 tt -63.6 -40.0 95.82 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 179.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? -61.66 -39.84 92.8 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -58.32 -49.75 76.08 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.629 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.488 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.9 p -68.06 -30.16 47.13 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.667 0 C-N-CA 120.327 -0.549 . . . . 0.0 109.795 -179.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.8 mmt -63.96 -42.25 97.34 Favored 'General case' 0 CA--C 1.491 -1.299 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.7 m -66.4 -32.44 73.82 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -73.56 -29.01 62.16 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.652 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 79.5 mt -91.2 -9.8 44.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.388 0.613 . . . . 0.0 110.165 -178.049 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 75.9 20.37 77.92 Favored Glycine 0 N--CA 1.435 -1.405 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.363 179.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -76.56 -27.53 55.93 Favored 'General case' 0 CA--C 1.495 -1.156 0 CA-C-N 116.98 0.39 . . . . 0.0 110.951 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 59.96 42.64 15.79 Favored 'General case' 0 C--O 1.236 0.362 0 O-C-N 124.32 1.013 . . . . 0.0 111.689 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 58.5 mt -86.27 154.8 21.0 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.476 ' H ' ' CD ' ' A' ' 120' ' ' GLU . 20.7 p -101.78 177.31 4.94 Favored 'General case' 0 N--CA 1.426 -1.626 0 C-N-CA 119.061 -1.056 . . . . 0.0 110.743 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.433 ' HA ' HG22 ' A' ' 121' ' ' VAL . 6.3 p-10 -65.21 -18.55 65.4 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.145 0.498 . . . . 0.0 110.853 -177.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -70.69 -57.05 5.09 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.472 -177.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.476 ' CD ' ' H ' ' A' ' 117' ' ' THR . 3.5 pm0 -70.08 -35.52 74.25 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.336 -177.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.486 ' O ' HG12 ' A' ' 125' ' ' ILE . 5.9 m -70.93 -26.56 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.42 -178.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -72.82 -35.64 67.34 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -67.48 -36.0 80.27 Favored 'General case' 0 C--N 1.352 0.704 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 176.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.42 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 65.2 mtt -55.15 -46.56 75.71 Favored 'General case' 0 CA--C 1.509 -0.608 0 O-C-N 124.145 0.903 . . . . 0.0 109.933 176.271 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.486 HG12 ' O ' ' A' ' 121' ' ' VAL . 51.2 mm -66.32 -53.99 30.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.258 177.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -45.82 -59.66 2.67 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 126.274 1.83 . . . . 0.0 114.555 -174.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -69.44 -20.08 63.77 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.921 0.391 . . . . 0.0 111.64 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -92.31 -21.26 20.38 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.636 0.732 . . . . 0.0 110.154 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -79.6 73.26 6.3 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 122.323 1.059 . . . . 0.0 110.282 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . 0.424 ' HB ' ' HG3' ' A' ' 140' ' ' GLU . 27.9 mt -82.98 -9.71 11.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 CA-C-N 114.605 -1.18 . . . . 0.0 108.757 176.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -84.8 -11.84 54.9 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.46 0.648 . . . . 0.0 109.537 -178.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 65.7 36.26 92.11 Favored Glycine 0 N--CA 1.436 -1.313 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.453 177.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -101.29 -16.38 16.96 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.329 0.585 . . . . 0.0 110.289 -176.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.15 0.25 68.19 Favored Glycine 0 C--N 1.312 -0.796 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -176.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.515 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 21.3 mt-30 -144.36 138.91 28.15 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.436 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.3 p -83.45 118.98 31.93 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -176.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.423 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 37.7 t30 -73.8 156.3 37.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.788 1.235 . . . . 0.0 110.489 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.467 ' O ' HG13 ' A' ' 142' ' ' VAL . 80.2 t80 -56.81 -48.79 77.18 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 122.738 0.415 . . . . 0.0 111.725 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.441 ' O ' HG22 ' A' ' 142' ' ' VAL . 27.0 mm-40 -65.98 -33.93 76.94 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.994 0.426 . . . . 0.0 111.971 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.424 ' HG3' ' HB ' ' A' ' 130' ' ' ILE . 1.3 mp0 -71.67 -34.5 69.76 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 121.219 0.533 . . . . 0.0 110.157 175.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -68.34 -42.46 79.24 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.81 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.467 HG13 ' O ' ' A' ' 138' ' ' TYR . 8.9 m -63.58 -36.61 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 120.283 -0.567 . . . . 0.0 109.646 178.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -64.7 -49.5 70.64 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.712 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -69.41 -44.61 71.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.515 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.7 tpt . . . . . 0 C--N 1.321 -0.64 0 N-CA-C 111.455 0.169 . . . . 0.0 111.455 -177.627 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt . . . . . 0 C--O 1.216 -0.665 0 CA-C-O 120.335 0.112 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -61.96 -35.72 79.31 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 123.099 0.559 . . . . 0.0 110.273 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.406 ' HB1' ' HE2' ' A' ' 124' ' ' MET . . . -60.25 -55.83 28.95 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.474 179.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.565 ' O ' HG12 ' B' ' 89' ' ' ILE . 35.9 m95 -67.43 -37.56 83.21 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 177.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -54.37 -56.78 15.17 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -63.14 -27.83 69.64 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.259 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.36 -55.16 8.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.618 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.565 HG12 ' O ' ' B' ' 85' ' ' TRP . 44.7 mm -57.38 -50.53 76.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.831 0.824 . . . . 0.0 109.188 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . 0.562 ' NE2' ' HB2' ' A' ' 41' ' ' GLN . 29.9 tt0 -61.51 -43.29 99.13 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 113.949 -1.478 . . . . 0.0 112.278 -176.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -76.15 -31.46 58.58 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.325 -0.55 . . . . 0.0 111.337 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.09 -38.08 89.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.545 0.688 . . . . 0.0 109.621 177.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 38.0 mttm . . . . . 0 C--N 1.315 -0.905 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.599 175.603 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.442 ' HB3' HD11 ' A' ' 9' ' ' ILE . 20.1 tp . . . . . 0 N--CA 1.416 -2.132 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.1 p -77.31 151.03 35.19 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.585 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -59.09 -36.1 74.55 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -176.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -58.85 -52.83 64.06 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 121.261 0.553 . . . . 0.0 109.72 177.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -62.58 -46.69 87.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.032 -177.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.515 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 75.2 mt -60.0 -36.71 68.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 O-C-N 123.588 0.555 . . . . 0.0 111.084 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.19 -44.93 86.83 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-O 120.647 0.26 . . . . 0.0 110.527 177.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -61.57 -36.63 81.19 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.717 176.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.475 ' CZ ' ' HG2' ' A' ' 72' ' ' MET . 56.0 m-85 -72.32 -33.94 67.71 Favored 'General case' 0 C--O 1.185 -2.323 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 177.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 99.2 mttt -59.03 -42.99 91.54 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.756 0.788 . . . . 0.0 109.794 176.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.34 -54.46 40.17 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.592 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.9 -31.44 69.23 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.042 -176.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -63.11 -48.25 79.33 Favored 'General case' 0 C--O 1.206 -1.237 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 177.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -68.84 -17.33 63.98 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.251 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.6 tp -72.0 -31.8 66.58 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.414 0.626 . . . . 0.0 110.04 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.49 ' CD2' HG21 ' A' ' 35' ' ' VAL . 10.5 m-85 -95.75 -35.86 11.39 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.114 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -77.64 99.38 5.77 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 175.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.69 -21.89 66.85 Favored 'General case' 0 C--N 1.307 -1.251 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -173.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.438 ' OD2' ' HB3' ' A' ' 24' ' ' ASP . 7.5 p-10 -113.12 -13.32 13.04 Favored 'General case' 0 C--N 1.305 -1.353 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.517 179.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.33 57.01 7.89 Favored Glycine 0 C--O 1.242 0.62 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.686 176.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.438 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 2.9 p-10 -112.91 -13.93 13.09 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 120.956 0.407 . . . . 0.0 110.518 -177.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.28 6.95 44.17 Favored Glycine 0 N--CA 1.433 -1.545 0 C-N-CA 121.172 -0.537 . . . . 0.0 112.79 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.447 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 74.6 p -137.78 131.27 30.97 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 117.288 0.544 . . . . 0.0 109.68 175.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.3 mt -102.26 124.99 56.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.993 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 177.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 27.0 p -94.3 167.7 11.37 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.294 178.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 40.0 p -64.82 -26.36 68.31 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 120.901 0.381 . . . . 0.0 110.238 177.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -55.32 -60.65 3.11 Favored 'General case' 0 C--O 1.242 0.668 0 C-N-CA 124.16 0.984 . . . . 0.0 108.941 174.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.88 -42.95 98.94 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 113.986 -1.461 . . . . 0.0 109.873 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -56.43 -61.73 2.21 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.878 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.17 -31.84 82.11 Favored Glycine 0 C--N 1.309 -0.969 0 C-N-CA 119.303 -1.427 . . . . 0.0 113.43 -174.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.6 m -67.59 -44.46 78.06 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 116.864 0.332 . . . . 0.0 111.068 178.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.514 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 31.3 m -71.48 -35.98 58.84 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 C-N-CA 119.699 -0.801 . . . . 0.0 110.152 178.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -64.11 -44.4 92.38 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.866 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -64.69 -33.42 75.9 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.86 0.362 . . . . 0.0 110.198 178.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 m -70.77 -21.46 62.5 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.091 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 92.2 mt -88.98 -22.77 22.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.71 0.291 . . . . 0.0 110.45 177.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.89 3.44 31.93 Favored Glycine 0 C--N 1.314 -0.693 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.728 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.457 ' C ' HD22 ' A' ' 42' ' ' ASN . 10.2 tp60 -101.47 131.47 47.58 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.304 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.457 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.47 79.87 37.84 Favored Pre-proline 0 C--N 1.298 -1.658 0 C-N-CA 119.709 -0.796 . . . . 0.0 112.704 177.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -78.81 153.97 26.2 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 121.703 1.602 . . . . 0.0 108.675 169.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.433 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 47.6 p -81.85 173.33 12.36 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.134 -178.02 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -59.12 -40.76 86.42 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 123.827 0.851 . . . . 0.0 110.658 -176.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.43 -35.87 68.43 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.248 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.433 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 23.0 mm-40 -60.51 -47.97 83.8 Favored 'General case' 0 C--O 1.241 0.607 0 O-C-N 123.502 0.501 . . . . 0.0 110.943 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.444 ' O ' HG13 ' A' ' 52' ' ' ILE . 78.9 mt -62.43 -41.06 98.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.129 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -67.52 -36.57 81.29 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.548 -177.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -67.57 -42.03 83.23 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.013 0.435 . . . . 0.0 109.983 178.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.5 tpp -60.06 -36.8 78.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.97 -1.013 . . . . 0.0 109.653 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 48' ' ' LEU . 49.0 mt -65.84 -50.21 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.143 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.4 175.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.504 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.0 t30 -60.98 -23.39 65.32 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -174.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.68 -44.4 73.32 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 123.98 0.912 . . . . 0.0 109.238 175.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.8 m -105.6 -15.49 8.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -177.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.504 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 27.7 t0 -72.17 103.8 3.44 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.062 0.458 . . . . 0.0 111.581 -176.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.07 -21.61 25.95 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.325 -179.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.05 -12.08 57.48 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.277 -174.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 62.8 29.84 75.22 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -173.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -100.12 -8.98 23.05 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.199 0.523 . . . . 0.0 110.853 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 86.82 12.83 68.07 Favored Glycine 0 N--CA 1.432 -1.602 0 CA-C-N 115.856 -0.611 . . . . 0.0 114.018 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.447 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 53.9 p -132.35 150.86 52.07 Favored 'General case' 0 C--O 1.255 1.363 0 CA-C-N 117.919 0.859 . . . . 0.0 111.124 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.405 HG13 HG12 ' A' ' 52' ' ' ILE . 86.1 mt -91.76 112.35 25.45 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.719 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -80.28 153.11 28.68 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 175.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.421 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 31.2 t80 -53.03 -50.15 83.51 Favored Pre-proline 0 CA--C 1.553 1.096 0 O-C-N 123.429 0.456 . . . . 0.0 111.93 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.1 Cg_endo -49.72 -47.55 22.62 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.653 2.235 . . . . 0.0 112.872 173.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -62.74 -41.42 99.17 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 121.786 0.803 . . . . 0.0 110.425 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -61.43 -43.97 97.95 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.382 176.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.6 mt -62.91 -35.11 78.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.937 178.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.9 m -58.68 -53.54 57.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 122.617 0.367 . . . . 0.0 111.191 178.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -64.97 -31.55 72.84 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.856 -177.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.475 ' HG2' ' CZ ' ' A' ' 12' ' ' PHE . 13.1 tpp -79.21 -38.75 34.95 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 119.66 -0.816 . . . . 0.0 110.978 -176.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.75 -24.31 62.59 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-O 120.682 0.277 . . . . 0.0 110.942 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -72.34 -27.34 62.35 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 121.244 0.545 . . . . 0.0 110.289 174.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.6 tttp -78.68 -47.76 16.34 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 176.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 65.6 mtp . . . . . 0 C--N 1.304 -1.377 0 CA-C-N 113.976 -1.465 . . . . 0.0 110.927 -177.162 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 N--CA 1.439 -1.018 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.54 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 47.5 mt-10 -53.59 -63.4 1.16 Allowed 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -170.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -83.95 -21.65 31.73 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 121.739 0.78 . . . . 0.0 109.589 -176.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.4 mm -66.75 -47.33 83.26 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.407 -172.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -73.28 -30.5 63.45 Favored 'General case' 0 N--CA 1.423 -1.82 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.45 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 39.4 mt-10 -64.63 -46.22 83.48 Favored 'General case' 0 C--O 1.247 0.938 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.115 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.455 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -67.68 -42.51 81.99 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.274 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -60.06 -45.63 92.24 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 178.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -60.85 -31.08 70.53 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.649 0.78 . . . . 0.0 112.465 -179.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 88' ' ' ALA . 14.5 p -79.52 -27.27 12.78 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 C-N-CA 119.173 -1.011 . . . . 0.0 111.63 -179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -82.14 -52.53 6.9 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -87.84 81.47 7.56 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 122.558 1.17 . . . . 0.0 108.159 175.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -76.09 -29.71 58.04 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 113.24 -1.8 . . . . 0.0 110.575 -174.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -73.97 -13.79 60.93 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.198 0.523 . . . . 0.0 110.72 178.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 66.24 42.83 93.98 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.981 -0.554 . . . . 0.0 113.491 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -98.56 -10.7 23.05 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 122.576 -0.367 . . . . 0.0 111.91 -179.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 102.19 4.45 50.55 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.357 -0.925 . . . . 0.0 113.24 174.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -151.99 132.42 13.78 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-O 121.168 0.509 . . . . 0.0 111.266 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.469 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.1 mt -79.11 128.59 38.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 -177.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.6 t -113.61 145.32 41.45 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 176.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.49 -50.45 62.71 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -173.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.36 -44.08 84.06 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 123.278 0.361 . . . . 0.0 111.86 -177.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -71.89 -37.74 70.08 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.992 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.491 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.1 tt -60.59 -43.5 97.3 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 178.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -64.41 -45.53 87.21 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 23.2 t-80 -59.2 -46.95 87.08 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.391 -178.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.546 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.2 p -66.38 -36.69 77.95 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.131 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.724 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.491 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.5 mmt -59.88 -42.27 93.4 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-O 120.699 0.285 . . . . 0.0 111.552 178.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 16.4 m -62.07 -35.42 78.6 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.633 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -74.39 -32.38 62.69 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.371 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.66 HD13 ' HA ' ' B' ' 92' ' ' ALA . 60.9 mt -84.9 -20.14 31.21 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.722 -174.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.68 35.61 6.8 Favored Glycine 0 N--CA 1.423 -2.179 0 C-N-CA 119.773 -1.204 . . . . 0.0 111.792 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.546 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 11.0 tp10 -120.19 111.98 18.51 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 176.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -80.28 94.36 6.08 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.767 -178.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.465 HD21 ' HG3' ' A' ' 114' ' ' GLU . 15.0 mt -119.89 132.3 55.51 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 105.735 -1.95 . . . . 0.0 105.735 176.033 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.4 p -94.27 -176.86 4.09 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 118.552 -1.259 . . . . 0.0 109.783 178.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -56.46 -42.07 77.57 Favored 'General case' 0 C--O 1.208 -1.098 0 C-N-CA 123.374 0.67 . . . . 0.0 111.585 -175.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -69.62 -24.7 63.69 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 113.399 0.888 . . . . 0.0 113.399 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -79.43 -46.91 16.63 Favored 'General case' 0 CA--C 1.499 -0.998 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.585 175.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.49 ' O ' HG12 ' A' ' 125' ' ' ILE . 13.9 m -65.67 -34.85 73.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.92 -43.13 99.64 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 123.516 0.726 . . . . 0.0 110.453 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -65.98 -40.93 91.65 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.401 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 64.2 mtt -60.87 -41.05 95.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.235 178.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.49 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.0 mm -65.26 -53.03 45.14 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.804 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -56.32 -40.7 74.82 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.359 0.664 . . . . 0.0 112.426 -175.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -79.57 -8.17 58.99 Favored 'General case' 0 C--N 1.309 -1.189 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.505 ' HB1' HG21 ' A' ' 136' ' ' VAL . . . -108.76 -22.58 12.16 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-O 121.3 0.572 . . . . 0.0 110.294 177.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -71.64 95.92 1.51 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 125.087 1.355 . . . . 0.0 109.479 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 63.3 mt -83.74 -48.69 17.05 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.167 -177.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -86.13 -11.3 53.0 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -172.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 84.7 66.87 1.44 Allowed Glycine 0 C--N 1.296 -1.647 0 C-N-CA 120.233 -0.984 . . . . 0.0 112.837 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -112.19 -16.35 13.02 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 177.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.06 5.41 67.92 Favored Glycine 0 CA--C 1.506 -0.516 0 N-CA-C 109.191 -1.563 . . . . 0.0 109.191 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -151.22 151.25 31.61 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.883 1.673 . . . . 0.0 106.868 -176.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.505 HG21 ' HB1' ' A' ' 128' ' ' ALA . 0.8 OUTLIER -104.28 116.2 47.63 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.971 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -176.689 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -78.49 161.09 27.32 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.528 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.432 ' O ' HG13 ' A' ' 142' ' ' VAL . 81.8 t80 -55.58 -45.24 77.41 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 123.165 0.586 . . . . 0.0 112.045 -177.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.418 ' O ' HG22 ' A' ' 142' ' ' VAL . 38.2 mm-40 -66.91 -21.47 65.99 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -84.32 -38.09 20.81 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 175.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -74.5 -25.03 59.1 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.681 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.432 HG13 ' O ' ' A' ' 138' ' ' TYR . 35.1 m -56.42 -27.94 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-O 121.116 0.484 . . . . 0.0 110.623 176.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -78.11 -64.3 1.19 Allowed 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 176.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 16.2 tpt -57.36 -28.72 63.41 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -171.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.317 -0.828 0 CA-C-O 121.324 0.583 . . . . 0.0 110.028 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 59.6 tttm . . . . . 0 N--CA 1.445 -0.685 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -71.34 -27.26 63.25 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.601 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.53 -53.45 54.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.965 179.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.401 ' CZ2' ' HB3' ' A' ' 124' ' ' MET . 32.2 m95 -67.36 -35.61 79.71 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 177.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -52.41 -55.37 22.23 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.181 0.925 . . . . 0.0 108.636 177.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -68.17 -38.56 82.21 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-N 114.129 -1.396 . . . . 0.0 112.581 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.35 -50.41 71.58 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -176.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 27.3 pt -72.9 -19.72 18.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.516 0.674 . . . . 0.0 112.456 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -79.16 -49.67 12.21 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-O 121.981 0.896 . . . . 0.0 109.535 175.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 91' ' ' LYS . . . . . 0.546 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 18.5 tptm -71.39 -53.97 12.28 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 125.939 1.696 . . . . 0.0 113.596 -175.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . 0.66 ' HA ' HD13 ' A' ' 112' ' ' LEU . . . -54.27 -51.92 63.02 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -169.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? . . . . . 0 N--CA 1.417 -2.105 0 O-C-N 122.13 -0.356 . . . . 0.0 111.378 -177.072 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.588 0 CA-C-O 120.517 0.199 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -125.46 15.87 8.25 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 121.565 -0.709 . . . . 0.0 109.914 -177.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.588 ' O ' HD13 ' A' ' 4' ' ' LEU . 15.8 pt20 -77.59 124.28 27.72 Favored 'General case' 0 CA--C 1.457 -2.613 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -174.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.588 HD13 ' O ' ' A' ' 3' ' ' GLN . 2.8 mm? -132.79 152.36 51.81 Favored 'General case' 0 N--CA 1.395 -3.203 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.225 168.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.461 ' O ' HG13 ' A' ' 9' ' ' ILE . 27.0 p -88.1 170.09 11.37 Favored 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 174.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -64.93 -43.82 91.51 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -174.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -64.89 -36.56 84.74 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.838 0.827 . . . . 0.0 108.987 178.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.431 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 6.0 tp-100 -62.39 -50.27 72.21 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.349 -1.296 . . . . 0.0 108.983 178.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 5' ' ' THR . 82.5 mt -59.14 -39.7 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.571 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.5 -34.66 77.3 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.151 0.501 . . . . 0.0 111.466 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -74.42 -36.59 63.44 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.431 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 23.7 m-85 -69.19 -31.59 70.31 Favored 'General case' 0 C--O 1.2 -1.509 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.861 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -55.43 -48.18 74.83 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 172.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.81 -58.86 6.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.37 178.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.34 -48.34 62.45 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.381 0.672 . . . . 0.0 111.117 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.428 ' HZ ' ' O ' ' A' ' 25' ' ' GLY . 64.2 t80 -56.1 -44.88 79.48 Favored 'General case' 0 C--O 1.213 -0.816 0 C-N-CA 124.312 1.045 . . . . 0.0 110.892 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.4 m -73.47 -27.44 61.4 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.723 -177.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.62 -34.07 77.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.009 0.433 . . . . 0.0 111.564 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -87.74 -36.59 17.26 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.901 176.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -76.85 87.98 3.44 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-O 122.12 0.962 . . . . 0.0 109.931 176.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.499 ' HE3' ' CG2' ' A' ' 34' ' ' THR . 61.5 mttm -68.66 -28.36 66.81 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.574 -1.193 . . . . 0.0 112.655 -175.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.539 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 23.9 m-20 -82.84 -14.12 54.92 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.541 -0.864 . . . . 0.0 110.539 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.85 44.42 97.09 Favored Glycine 0 CA--C 1.517 0.205 0 O-C-N 123.353 0.408 . . . . 0.0 112.082 -178.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.539 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 4.6 p30 -113.18 -16.45 12.57 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 120.797 0.332 . . . . 0.0 111.018 -176.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.428 ' O ' ' HZ ' ' A' ' 16' ' ' PHE . . . 102.32 4.42 50.17 Favored Glycine 0 N--CA 1.431 -1.646 0 C-N-CA 120.014 -1.088 . . . . 0.0 114.666 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 27.9 p -138.63 130.77 28.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 118.33 1.065 . . . . 0.0 110.769 172.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 56.6 mt -93.1 128.68 44.43 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 C-N-CA 122.371 0.269 . . . . 0.0 110.368 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 p -101.47 171.51 7.53 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 123.635 0.774 . . . . 0.0 110.149 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 47.1 p -69.19 -24.84 64.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.273 0.559 . . . . 0.0 109.907 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -57.63 -53.08 62.2 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.236 175.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -67.66 -42.8 81.59 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 114.124 -1.398 . . . . 0.0 110.723 -176.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.1 mt -59.67 -54.19 49.25 Favored 'General case' 0 C--O 1.204 -1.303 0 O-C-N 123.767 0.667 . . . . 0.0 110.314 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.91 -27.99 69.54 Favored Glycine 0 C--N 1.313 -0.741 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.035 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.499 ' CG2' ' HE3' ' A' ' 21' ' ' LYS . 58.0 m -75.6 -43.15 49.61 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 116.941 0.371 . . . . 0.0 110.804 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.416 HG13 ' HE2' ' A' ' 21' ' ' LYS . 31.5 m -68.5 -33.98 63.0 Favored 'Isoleucine or valine' 0 C--N 1.344 0.34 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.487 178.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -65.5 -40.63 93.25 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.262 173.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -59.8 -48.07 83.15 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 123.137 0.575 . . . . 0.0 110.072 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.3 m -69.51 -21.1 63.7 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.305 0.574 . . . . 0.0 111.041 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.558 HD11 ' O ' ' A' ' 112' ' ' LEU . 3.4 tm? -83.05 -23.2 33.27 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.73 39.71 3.09 Favored Glycine 0 N--CA 1.433 -1.521 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.512 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.473 ' C ' HD22 ' A' ' 42' ' ' ASN . 35.6 tt0 -143.96 135.58 26.05 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 177.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.473 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.76 84.36 43.56 Favored Pre-proline 0 C--N 1.301 -1.515 0 O-C-N 122.167 -0.333 . . . . 0.0 110.193 176.255 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -76.83 170.87 19.02 Favored 'Trans proline' 0 C--O 1.242 0.721 0 C-N-CA 122.475 2.117 . . . . 0.0 110.163 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.524 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 77.0 p -89.42 164.38 14.88 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.904 -177.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -57.17 -41.66 79.67 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 124.356 1.062 . . . . 0.0 108.45 176.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.92 -42.35 98.98 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.094 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.524 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 7.8 mm-40 -62.92 -47.57 82.69 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 121.211 0.529 . . . . 0.0 110.965 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.4 mt -69.7 -38.12 76.84 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.503 -176.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -64.45 -45.57 86.88 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -61.47 -44.14 97.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.404 177.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 51.3 tpp -55.63 -44.09 76.79 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.016 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.7 mt -65.02 -56.26 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.569 176.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.448 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.5 t30 -58.92 -23.7 61.57 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -172.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -66.5 -38.77 87.97 Favored 'General case' 0 N--CA 1.386 -3.663 0 C-N-CA 123.122 0.569 . . . . 0.0 111.679 175.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.627 HG11 ' SD ' ' A' ' 71' ' ' MET . 8.6 m -95.87 -18.79 6.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 120.838 0.351 . . . . 0.0 110.454 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.448 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 38.4 t70 -70.62 89.84 0.74 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.67 -178.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.37 -27.11 23.0 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.207 -176.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -82.23 -11.71 58.51 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.384 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.08 17.98 79.69 Favored Glycine 0 N--CA 1.434 -1.451 0 CA-C-O 119.457 -0.635 . . . . 0.0 114.228 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.0 p30 -81.39 -16.31 52.59 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.043 1.421 . . . . 0.0 111.871 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.78 4.71 58.94 Favored Glycine 0 N--CA 1.441 -0.968 0 C-N-CA 120.545 -0.836 . . . . 0.0 114.027 177.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.0 p -135.78 166.77 22.52 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 117.909 0.855 . . . . 0.0 111.198 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.3 mt -91.27 111.62 24.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -89.66 161.4 16.13 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 176.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.426 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 37.1 t80 -58.5 -50.11 89.85 Favored Pre-proline 0 CA--C 1.553 1.086 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.5 Cg_endo -49.23 -41.92 41.06 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.853 2.368 . . . . 0.0 112.479 174.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -70.64 -41.06 72.67 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.517 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.692 ' CZ ' ' HA ' ' B' ' 100' ' ' ALA . 1.4 t80 -59.23 -45.0 92.31 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.729 174.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.51 -45.7 80.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.338 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.519 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 43.5 m -57.35 -54.32 48.18 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 123.618 0.574 . . . . 0.0 110.816 174.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.627 ' SD ' HG11 ' A' ' 55' ' ' VAL . 35.6 ttp -53.69 -51.72 62.32 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 123.737 0.815 . . . . 0.0 112.035 -178.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.406 ' HG2' ' CE1' ' A' ' 12' ' ' PHE . 34.2 tpp -67.74 -43.27 80.31 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.65 -28.88 69.7 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 123.726 0.641 . . . . 0.0 111.54 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 70' ' ' THR . 51.6 mtp180 -79.21 -36.39 40.23 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.177 177.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -72.79 -30.66 64.27 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 121.465 0.65 . . . . 0.0 110.809 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.447 ' HG3' ' HD2' ' A' ' 148' ' ' LYS . 56.6 ttp -84.14 -16.31 44.02 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.684 -176.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -142.16 -74.63 0.3 Allowed 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 119.688 -0.805 . . . . 0.0 112.216 -175.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -153.86 142.33 20.71 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 117.67 0.214 . . . . 0.0 110.459 -178.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.454 ' HA ' ' HE ' ' A' ' 74' ' ' ARG . 0.9 OUTLIER -79.51 -29.55 41.58 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 168.434 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.0 t70 176.65 -55.06 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 112.465 -2.152 . . . . 0.0 106.307 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.4 p -108.44 -173.32 2.25 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 113.68 -1.6 . . . . 0.0 110.54 -177.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -76.51 11.9 1.45 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.946 0.899 . . . . 0.0 112.66 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -51.36 -50.71 58.97 Favored 'General case' 0 CA--C 1.503 -0.844 0 C-N-CA 123.333 0.653 . . . . 0.0 111.778 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 74' ' ' ARG . 8.2 mm-40 -60.03 -35.32 74.84 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.46 -176.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.44 HG21 HG12 ' A' ' 142' ' ' VAL . 30.3 mm -74.97 -45.04 43.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.732 -177.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.1 ttt180 -71.48 -35.86 70.96 Favored 'General case' 0 C--O 1.21 -1.021 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.401 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.426 ' CD ' HH21 ' A' ' 90' ' ' ARG . 5.6 mm-40 -61.91 -35.89 79.7 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.637 0.256 . . . . 0.0 111.597 175.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.431 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -68.64 -44.3 74.46 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 176.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -59.9 -41.67 92.17 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 121.317 0.579 . . . . 0.0 109.533 178.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.426 HH21 ' CD ' ' A' ' 87' ' ' GLU . 7.0 tmm_? -61.7 -36.82 82.0 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 125.356 1.462 . . . . 0.0 111.822 -178.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.464 HG11 ' O ' ' B' ' 92' ' ' ALA . 9.6 p -80.43 -19.01 12.05 Favored 'Isoleucine or valine' 0 C--O 1.248 0.982 0 CA-C-O 121.589 0.709 . . . . 0.0 111.066 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -88.06 -54.3 4.29 Favored 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 120.025 -0.67 . . . . 0.0 111.467 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -104.07 87.57 2.8 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.049 0.452 . . . . 0.0 110.373 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.407 ' N ' ' HD3' ' A' ' 94' ' ' LYS . 3.3 mppt? -80.11 -28.13 39.06 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.525 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -77.44 -13.24 59.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.127 -171.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.7 62.46 3.01 Favored Glycine 0 N--CA 1.431 -1.645 0 C-N-CA 120.091 -1.052 . . . . 0.0 111.542 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -96.7 -18.64 19.53 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 176.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.86 -5.01 85.9 Favored Glycine 0 N--CA 1.441 -1.0 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -177.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.604 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 61.1 m-85 -143.54 143.36 31.5 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 -178.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.482 ' HB ' HG13 ' A' ' 136' ' ' VAL . 6.3 mt -80.22 125.2 38.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.759 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.6 m -95.57 140.06 30.94 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.13 -40.25 97.05 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.576 0.35 . . . . 0.0 111.532 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.57 -37.06 80.06 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.05 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 67.5 tt0 -77.3 -36.83 53.79 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.662 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.9 tt -66.55 -36.8 83.56 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.443 ' HB2' HG21 ' A' ' 121' ' ' VAL . 2.7 tmt_? -62.0 -40.82 96.94 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -64.36 -44.95 89.83 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.328 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.564 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.2 p -66.51 -32.3 57.45 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.172 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.421 ' HG3' HD12 ' A' ' 116' ' ' LEU . 20.5 mmt -64.39 -40.12 95.2 Favored 'General case' 0 CA--C 1.5 -0.965 0 N-CA-C 111.89 0.329 . . . . 0.0 111.89 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 12.4 m -62.52 -35.85 80.72 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -74.45 -28.94 61.26 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.913 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 70.4 mt -90.64 -14.87 31.49 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 121.139 0.495 . . . . 0.0 110.25 -176.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.58 3.47 86.33 Favored Glycine 0 N--CA 1.436 -1.346 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.889 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.532 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 24.0 mm-40 -70.67 -30.46 67.06 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.981 0.39 . . . . 0.0 110.01 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 51.93 86.6 0.04 OUTLIER 'General case' 0 C--O 1.246 0.91 0 O-C-N 124.594 1.184 . . . . 0.0 112.569 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.421 HD12 ' HG3' ' A' ' 109' ' ' MET . 62.4 mt -113.05 148.8 34.43 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.217 -178.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 9.4 p -77.09 165.21 24.9 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.993 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.9 -40.29 97.11 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.46 -35.64 81.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.891 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.77 -55.65 16.14 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.701 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.443 HG21 ' HB2' ' A' ' 106' ' ' ARG . 15.1 m -64.16 -33.13 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.421 -178.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -63.85 -43.13 97.07 Favored 'General case' 0 CA--C 1.507 -0.68 0 C-N-CA 123.193 0.597 . . . . 0.0 109.642 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -67.36 -43.66 80.9 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.907 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.51 ' HA ' ' CZ ' ' B' ' 81' ' ' PHE . 62.8 mtt -57.8 -48.9 78.39 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.941 177.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 35.4 mm -64.26 -43.38 97.23 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.579 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.556 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -56.24 -44.32 79.52 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 123.09 0.556 . . . . 0.0 112.182 -176.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -71.56 -31.74 67.32 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 119.924 -0.711 . . . . 0.0 110.88 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.463 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -79.5 -30.51 42.0 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.645 -178.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -72.47 91.91 1.42 Allowed 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 124.454 1.102 . . . . 0.0 108.07 173.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 68.2 mt -81.72 -42.41 19.27 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.786 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.274 -173.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -79.54 -12.05 59.87 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.892 -176.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.35 50.45 5.07 Favored Glycine 0 C--N 1.31 -0.911 0 C-N-CA 120.431 -0.89 . . . . 0.0 113.609 175.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -100.27 -15.54 18.02 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 122.074 0.94 . . . . 0.0 108.51 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 94.5 -0.1 65.33 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.604 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 24.0 mt-30 -142.29 140.92 32.35 Favored 'General case' 0 N--CA 1.429 -1.52 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 -178.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.482 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.6 OUTLIER -99.1 122.17 50.54 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -175.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.462 ' ND2' ' HG3' ' A' ' 140' ' ' GLU . 0.5 OUTLIER -85.56 171.75 11.48 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.941 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.61 ' O ' HG13 ' A' ' 142' ' ' VAL . 75.2 t80 -54.57 -47.0 73.81 Favored 'General case' 0 C--O 1.219 -0.502 0 C-N-CA 123.225 0.61 . . . . 0.0 112.325 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.76 -23.67 67.46 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.072 0.463 . . . . 0.0 112.095 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.462 ' HG3' ' ND2' ' A' ' 137' ' ' ASN . 44.5 mt-10 -86.89 -37.86 17.28 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-O 121.713 0.768 . . . . 0.0 108.977 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -70.34 -30.47 67.43 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.3 -0.864 . . . . 0.0 112.102 -179.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.61 HG13 ' O ' ' A' ' 138' ' ' TYR . 28.9 m -59.83 -35.01 57.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -76.96 -34.11 57.62 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.644 0.735 . . . . 0.0 109.41 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.463 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 92.6 mmm -76.24 -35.65 58.88 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.403 -176.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 14.6 tpt -65.13 -38.64 91.29 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.354 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 8.2 m -82.46 -9.45 59.43 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-O 121.544 0.688 . . . . 0.0 110.71 -179.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -88.33 78.08 8.05 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.372 0.606 . . . . 0.0 110.6 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.478 ' HD3' ' HA ' ' B' ' 86' ' ' LYS . 57.1 mttm . . . . . 0 C--N 1.307 -1.278 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 N--CA 1.434 -1.239 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -76.67 -176.11 2.97 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 123.176 2.584 . . . . 0.0 113.234 -177.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -145.41 88.99 1.89 Allowed 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -132.29 -35.79 1.16 Allowed 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -176.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 7.2 m -55.25 -63.34 1.19 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.108 0.563 . . . . 0.0 111.034 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -113.37 -22.64 10.3 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 177.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 72.3 t60 71.16 -59.69 0.54 Allowed 'General case' 0 C--O 1.216 -0.659 0 C-N-CA 125.88 1.672 . . . . 0.0 111.926 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . 0.51 ' CZ ' ' HA ' ' A' ' 124' ' ' MET . 16.2 t80 -60.01 -54.37 46.83 Favored 'General case' 0 C--O 1.203 -1.366 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -178.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -57.19 -47.11 82.08 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 124.0 0.813 . . . . 0.0 111.383 -176.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' B' ' 86' ' ' LYS . 1.6 mp0 -66.43 -41.91 88.49 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 178.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -69.8 -41.78 74.58 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.99 0.424 . . . . 0.0 110.47 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 77.3 t-105 -66.31 -22.72 66.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 122.673 1.225 . . . . 0.0 109.196 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . 0.544 ' O ' ' HG3' ' B' ' 90' ' ' GLN . 85.2 tttt -78.97 -63.59 1.38 Allowed 'General case' 0 C--N 1.267 -3.016 0 CA-C-N 115.049 -0.978 . . . . 0.0 108.808 174.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . 0.404 ' HA ' ' OE1' ' B' ' 90' ' ' GLN . 31.1 m170 -63.71 -52.14 61.87 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -170.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.12 -29.94 69.82 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.164 0.507 . . . . 0.0 111.126 -176.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 42.8 mm -83.14 -28.62 7.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.22 -178.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . 0.544 ' HG3' ' O ' ' B' ' 86' ' ' LYS . 50.7 mt-30 -62.65 -46.48 88.02 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 174.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.532 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 24.6 tptm -64.68 -25.91 68.15 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.082 -1.417 . . . . 0.0 112.164 -178.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.464 ' O ' HG11 ' A' ' 91' ' ' VAL . . . -76.83 -10.85 59.66 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -176.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -60.93 -28.82 69.22 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -172.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -145.59 165.36 28.88 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.52 ' HB2' ' HD3' ' B' ' 96' ' ' PRO . 1.7 mpt? -64.7 -57.65 15.9 Favored Pre-proline 0 C--O 1.219 -0.527 0 C-N-CA 120.244 -0.582 . . . . 0.0 110.02 173.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.52 ' HD3' ' HB2' ' B' ' 95' ' ' MET . 18.9 Cg_endo -97.01 60.97 0.11 Allowed 'Trans proline' 0 C--N 1.37 1.702 0 C-N-CA 122.081 1.854 . . . . 0.0 108.491 174.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -83.47 125.71 73.27 Favored Pre-proline 0 C--N 1.315 -0.93 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.902 -173.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -91.6 117.9 0.49 Allowed 'Trans proline' 0 N--CA 1.417 -3.026 0 C-N-CA 122.027 1.818 . . . . 0.0 110.578 172.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 37.8 p-90 -90.01 12.77 16.61 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-O 122.032 0.92 . . . . 0.0 109.077 174.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . 0.692 ' HA ' ' CZ ' ' A' ' 68' ' ' PHE . . . . . . . . 0 N--CA 1.401 -2.925 0 N-CA-C 104.872 -2.27 . . . . 0.0 104.872 176.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.285 0 CA-C-O 120.957 0.408 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -94.02 81.47 4.13 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.464 0.65 . . . . 0.0 110.28 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -128.06 97.52 4.81 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.782 178.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.439 ' HB3' HD11 ' A' ' 9' ' ' ILE . 8.9 tp -129.96 130.26 44.83 Favored 'General case' 0 N--CA 1.42 -1.963 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.23 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.6 p -73.17 151.47 41.5 Favored 'General case' 0 N--CA 1.424 -1.727 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.271 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -53.92 -43.12 69.47 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -173.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -70.0 -33.38 71.96 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.853 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -61.64 -48.89 78.83 Favored 'General case' 0 C--O 1.212 -0.884 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 175.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.459 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 43.3 mt -60.51 -33.66 55.25 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.683 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.601 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.428 ' O ' ' HB2' ' A' ' 13' ' ' LYS . . . -65.29 -41.05 94.53 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.534 0.683 . . . . 0.0 110.25 175.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -65.88 -37.78 87.04 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.355 0.598 . . . . 0.0 109.634 175.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.538 ' HZ ' ' SD ' ' A' ' 76' ' ' MET . 46.4 m-85 -69.67 -25.05 63.71 Favored 'General case' 0 C--O 1.176 -2.791 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.885 177.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 33.1 mmtp -60.28 -47.78 84.56 Favored 'General case' 0 C--O 1.25 1.125 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 172.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.55 -55.39 20.8 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.379 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.89 82.32 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.166 -0.925 . . . . 0.0 113.136 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -65.6 -45.79 81.82 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -69.14 -16.92 63.76 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.681 -177.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.48 -42.27 99.36 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 171.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.416 ' CD2' HG21 ' A' ' 35' ' ' VAL . 65.4 m-85 -81.32 -51.36 8.45 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.825 178.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -70.64 98.89 1.57 Allowed 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.801 0.81 . . . . 0.0 110.551 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mmtm -77.56 -15.82 59.01 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 114.793 -1.094 . . . . 0.0 113.366 -174.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.482 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 11.1 m-20 -95.42 -14.38 23.84 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.648 -176.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.26 40.34 87.59 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.482 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 5.5 p30 -113.12 -15.23 12.82 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -175.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.23 14.08 60.91 Favored Glycine 0 C--N 1.313 -0.696 0 C-N-CA 120.961 -0.637 . . . . 0.0 113.539 178.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.5 p -134.76 131.39 37.5 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 174.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.8 mt -104.72 121.34 56.45 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.3 p -92.74 171.99 8.64 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.689 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.4 HG23 HD12 ' A' ' 52' ' ' ILE . 11.7 p -59.81 -35.34 74.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.558 0.694 . . . . 0.0 109.648 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -54.43 -51.0 66.33 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.109 1.364 . . . . 0.0 110.506 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -70.84 -36.38 72.86 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.272 -175.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 85.5 mt -61.65 -51.22 69.36 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 175.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.1 -29.45 74.45 Favored Glycine 0 N--CA 1.441 -1.021 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.428 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.3 m -61.18 -53.28 58.88 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 116.975 0.388 . . . . 0.0 110.433 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.416 HG21 ' CD2' ' A' ' 19' ' ' PHE . 33.9 m -71.02 -31.54 45.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.349 -177.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.451 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 64.9 mtt -68.14 -37.74 81.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.221 177.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -65.11 -31.9 73.34 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 177.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.6 m -75.33 -13.86 60.44 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.545 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -104.57 6.14 34.35 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.167 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.02 23.14 64.32 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 116.0 -0.545 . . . . 0.0 113.524 178.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.505 ' HG3' ' HD3' ' A' ' 43' ' ' PRO . 5.4 tp-100 -120.8 131.53 54.51 Favored 'General case' 0 N--CA 1.424 -1.754 0 O-C-N 122.226 -0.573 . . . . 0.0 110.474 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.46 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -123.29 79.32 53.11 Favored Pre-proline 0 C--N 1.296 -1.737 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.505 ' HD3' ' HG3' ' A' ' 41' ' ' GLN . 31.8 Cg_exo -65.89 164.24 27.89 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 122.188 1.925 . . . . 0.0 110.84 176.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.436 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 46.9 p -76.75 166.02 23.94 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 -179.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -60.07 -36.47 77.42 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.89 -45.78 93.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.66 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.436 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 34.1 mm-40 -60.49 -43.45 96.98 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.443 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.05 -46.8 76.49 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.95 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 47.1 tp60 -68.64 -42.65 77.68 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -61.39 -42.24 98.4 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.375 0.607 . . . . 0.0 109.854 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 45.0 ttm -54.31 -46.85 72.91 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.506 177.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.4 HD12 HG23 ' A' ' 29' ' ' THR . 40.2 mt -67.54 -53.61 30.35 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.178 178.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.401 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 12.7 t30 -54.99 -27.54 44.98 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -172.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -66.65 -42.3 86.87 Favored 'General case' 0 N--CA 1.386 -3.658 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 178.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.458 HG11 ' SD ' ' A' ' 71' ' ' MET . 4.3 m -94.82 -14.59 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-O 120.863 0.363 . . . . 0.0 111.321 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.401 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 54.0 t0 -69.28 104.83 2.33 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.54 -35.61 22.74 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.364 -173.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -91.01 -10.55 41.86 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.593 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.65 52.21 36.06 Favored Glycine 0 C--O 1.239 0.429 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.768 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -107.69 -13.89 14.93 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.537 0.208 . . . . 0.0 111.452 -178.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.9 -3.27 33.79 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.239 -0.982 . . . . 0.0 113.563 179.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.9 p -127.83 151.25 49.28 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 117.504 0.652 . . . . 0.0 110.84 178.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.1 mt -91.58 104.69 15.78 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.086 0 N-CA-C 104.198 -2.519 . . . . 0.0 104.198 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.13 158.82 20.29 Favored 'General case' 0 C--N 1.283 -2.303 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -175.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.426 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 52.0 t80 -51.46 -51.69 66.85 Favored Pre-proline 0 CA--C 1.554 1.122 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -176.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.41 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 8.5 Cg_endo -50.52 -44.57 39.18 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.774 2.316 . . . . 0.0 112.838 175.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -69.04 -36.94 78.27 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.537 0.684 . . . . 0.0 110.304 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -63.54 -39.64 94.94 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.092 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 87.2 mt -65.86 -44.02 86.67 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.141 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 93.2 m -54.99 -49.12 72.27 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 123.867 0.73 . . . . 0.0 109.656 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.458 ' SD ' HG11 ' A' ' 55' ' ' VAL . 17.9 ttp -54.41 -52.76 60.71 Favored 'General case' 0 C--O 1.199 -1.591 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.861 176.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.0 mmt -64.23 -42.67 96.46 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -174.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.39 -35.25 71.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.625 0.726 . . . . 0.0 110.486 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.516 ' HB3' ' OG1' ' A' ' 79' ' ' THR . 66.4 mtp180 -83.8 -32.79 25.16 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.126 178.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -83.29 -35.57 25.17 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 123.077 0.551 . . . . 0.0 112.22 -168.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.538 ' SD ' ' HZ ' ' A' ' 12' ' ' PHE . 63.6 mtm -80.4 -40.78 25.82 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.489 0.662 . . . . 0.0 110.542 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -81.09 -23.41 38.45 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.806 -1.088 . . . . 0.0 113.008 -173.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.4 t70 84.66 124.57 0.04 OUTLIER 'General case' 0 CA--C 1.487 -1.476 0 C-N-CA 125.544 1.538 . . . . 0.0 107.789 -167.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.516 ' OG1' ' HB3' ' A' ' 74' ' ' ARG . 22.2 m -76.13 -67.98 0.63 Allowed 'General case' 0 N--CA 1.409 -2.52 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.525 -172.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.498 ' OD1' ' HB3' ' A' ' 82' ' ' GLU . 21.1 t70 -141.24 -19.18 0.79 Allowed 'General case' 0 C--N 1.275 -2.662 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.894 -172.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.557 ' O ' HG12 ' A' ' 85' ' ' ILE . 50.4 m 75.5 -55.78 0.62 Allowed 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 125.17 1.388 . . . . 0.0 110.62 -176.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.498 ' HB3' ' OD1' ' A' ' 80' ' ' ASP . 20.0 tp10 -58.71 -48.73 80.14 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.271 0.628 . . . . 0.0 109.751 179.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -64.73 -27.45 68.92 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 121.056 0.455 . . . . 0.0 111.542 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.66 -27.25 55.54 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.858 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.557 HG12 ' O ' ' A' ' 81' ' ' SER . 27.2 mm -72.32 -38.61 61.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 174.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -61.74 -42.77 99.4 Favored 'General case' 0 C--O 1.21 -0.996 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.296 174.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -56.33 -51.75 67.09 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.432 ' HA ' HG12 ' A' ' 91' ' ' VAL . . . -59.04 -43.64 91.68 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.197 179.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.36 -54.02 49.18 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.68 -43.67 69.09 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 125.166 1.386 . . . . 0.0 112.707 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.432 HG12 ' HA ' ' A' ' 88' ' ' ALA . 11.9 p -72.15 -25.94 24.28 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.536 -176.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -82.06 -56.07 4.18 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 175.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -84.23 85.07 7.41 Favored 'General case' 0 C--O 1.252 1.212 0 CA-C-O 122.124 0.964 . . . . 0.0 110.663 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -78.65 -35.02 45.97 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 114.447 -1.251 . . . . 0.0 112.798 -178.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -73.32 -13.57 61.14 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 121.186 0.517 . . . . 0.0 111.003 -178.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.63 52.6 9.62 Favored Glycine 0 N--CA 1.43 -1.715 0 N-CA-C 109.937 -1.265 . . . . 0.0 109.937 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -87.94 -18.62 28.72 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.22 6.07 88.34 Favored Glycine 0 CA--C 1.501 -0.805 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.558 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 98.5 m-85 -147.34 149.85 33.6 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 -178.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.51 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.9 mt -93.48 123.3 45.52 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.875 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 175.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 29.9 t -104.06 151.94 22.65 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 123.723 0.809 . . . . 0.0 109.451 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.31 -34.91 79.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.776 178.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.25 86.23 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.089 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.561 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 2.1 tp10 -68.33 -41.17 81.19 Favored 'General case' 0 CA--C 1.503 -0.856 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.437 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -61.43 -39.32 90.37 Favored 'General case' 0 N--CA 1.427 -1.601 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -175.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.708 ' HG3' HG21 ' A' ' 121' ' ' VAL . 19.5 mtm180 -56.65 -42.8 79.57 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.401 172.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.561 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 50.3 m170 -54.52 -56.04 22.97 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.584 0.753 . . . . 0.0 110.697 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.406 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.2 p -70.94 -35.65 60.5 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.137 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.187 -174.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 22.7 mmt -63.49 -45.28 91.44 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -177.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.8 p -65.23 -36.01 82.82 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-O 121.135 0.493 . . . . 0.0 110.129 176.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -66.0 -32.58 74.14 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.696 178.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 78.9 mt -85.05 -17.91 36.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.824 -177.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 80.33 23.84 60.16 Favored Glycine 0 N--CA 1.435 -1.414 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.451 -177.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -84.99 -35.22 22.11 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 55.4 tptt 47.58 88.25 0.02 OUTLIER 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.648 1.579 . . . . 0.0 113.611 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 64.6 mt -101.06 155.63 17.88 Favored 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 24.3 p -75.78 166.09 24.06 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 175.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -63.52 -34.14 77.14 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -64.13 -44.58 91.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.159 176.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.464 ' HG3' ' CE2' ' B' ' 81' ' ' PHE . 14.2 tt0 -70.5 -35.66 73.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.855 -174.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.708 HG21 ' HG3' ' A' ' 106' ' ' ARG . 19.2 m -72.52 -33.27 44.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.897 176.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -70.94 -41.86 70.57 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.284 -177.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.524 ' HB2' ' CZ ' ' B' ' 81' ' ' PHE . 48.9 mm-40 -68.55 -31.08 70.04 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.016 177.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.4 mtt -58.8 -48.53 80.96 Favored 'General case' 0 CA--C 1.497 -1.071 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.263 175.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.11 -46.57 96.18 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.533 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.656 178.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -55.67 -44.41 77.26 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.25 0.62 . . . . 0.0 111.48 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -66.17 -28.82 69.07 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.094 0.558 . . . . 0.0 111.37 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.478 ' HB1' HG21 ' A' ' 136' ' ' VAL . . . -97.52 -20.57 17.64 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.624 -0.431 . . . . 0.0 112.05 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.404 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 5.4 t70 -70.24 93.22 0.82 Allowed 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 124.052 0.941 . . . . 0.0 110.244 177.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.1 mt -84.53 -40.31 15.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.229 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -83.76 -10.99 57.72 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.259 0.552 . . . . 0.0 112.305 -172.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.404 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 75.64 55.75 4.87 Favored Glycine 0 C--N 1.307 -1.083 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.587 176.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -111.84 -17.08 13.02 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 177.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.32 4.62 60.94 Favored Glycine 0 N--CA 1.439 -1.136 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.558 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 26.7 mt-30 -147.76 145.12 28.69 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.51 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.0 OUTLIER -102.81 120.4 52.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -176.094 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -86.05 168.3 14.22 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.433 ' O ' HG13 ' A' ' 142' ' ' VAL . 68.2 t80 -55.62 -46.83 77.33 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.971 0.909 . . . . 0.0 112.852 -174.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.476 ' HA ' HG22 ' A' ' 142' ' ' VAL . 28.9 mm-40 -67.45 -26.61 66.48 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -178.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -73.62 -44.87 55.88 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -63.95 -38.7 92.04 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.759 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.476 HG22 ' HA ' ' A' ' 139' ' ' GLU . 15.9 m -66.85 -35.02 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.633 177.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -72.73 -37.98 67.56 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.412 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 1.5 tmt? -72.54 -50.88 22.6 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.917 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -35.67 79.44 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.167 0.587 . . . . 0.0 110.548 -174.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 17.0 m -80.55 -6.33 58.08 Favored 'General case' 0 CA--C 1.561 1.376 0 CA-C-O 121.583 0.706 . . . . 0.0 110.745 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -120.27 19.35 12.16 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 122.364 1.078 . . . . 0.0 109.919 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.409 ' HE3' ' HB3' ' A' ' 148' ' ' LYS . 12.0 ttpp . . . . . 0 C--N 1.278 -2.51 0 CA-C-N 113.858 -1.519 . . . . 0.0 108.281 -178.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.448 -0.527 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -80.75 -25.68 4.19 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 122.765 2.31 . . . . 0.0 112.683 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.29 -6.77 52.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.759 0.314 . . . . 0.0 110.424 -178.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 67.99 82.13 0.18 Allowed 'General case' 0 C--O 1.25 1.094 0 C-N-CA 124.741 1.216 . . . . 0.0 110.19 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 16.3 m -67.08 -22.4 65.84 Favored 'General case' 0 C--N 1.307 -1.239 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.347 -177.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -69.7 -51.05 37.91 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -63.34 -47.23 83.04 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.349 -0.842 . . . . 0.0 109.265 177.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . 0.524 ' CZ ' ' HB2' ' A' ' 123' ' ' GLU 0.322 64.4 m-85 -74.41 -16.27 60.89 Favored 'General case' 0 N--CA 1.422 -1.86 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 -175.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -71.66 -28.93 64.07 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 176.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -77.16 -45.08 27.94 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 175.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' B' ' 81' ' ' PHE . . . -57.73 -49.98 74.76 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.512 179.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -60.22 -38.14 82.47 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -63.38 -29.97 71.18 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 121.364 0.602 . . . . 0.0 110.897 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -84.12 -43.56 14.91 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.091 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.0 -56.76 18.05 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 123.732 0.813 . . . . 0.0 112.312 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 74.2 mt -62.15 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.086 0.469 . . . . 0.0 110.672 -176.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -66.64 -36.31 82.28 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.286 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -73.16 -38.58 66.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.37 -41.2 94.02 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.978 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -72.23 -7.13 47.63 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.079 0.466 . . . . 0.0 110.034 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.41 ' CB ' ' HB2' ' B' ' 97' ' ' ASP . 31.3 m170 83.04 123.65 0.04 OUTLIER 'General case' 0 CA--C 1.504 -0.817 0 C-N-CA 127.001 2.12 . . . . 0.0 113.386 177.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.51 ' HB2' ' HD3' ' B' ' 96' ' ' PRO . 84.8 mtp -90.9 -51.1 0.32 Allowed Pre-proline 0 C--N 1.314 -0.966 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.628 171.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.51 ' HD3' ' HB2' ' B' ' 95' ' ' MET . 16.2 Cg_exo -70.89 98.59 0.8 Allowed 'Trans proline' 0 C--N 1.389 2.703 0 N-CA-C 106.627 -2.105 . . . . 0.0 106.627 164.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . 0.41 ' HB2' ' CB ' ' B' ' 94' ' ' HIS . 15.5 t70 -170.22 159.44 6.36 Favored Pre-proline 0 C--N 1.296 -1.726 0 N-CA-C 105.489 -2.041 . . . . 0.0 105.489 -167.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -62.35 85.22 0.1 Allowed 'Trans proline' 0 N--CA 1.45 -1.082 0 C-N-CA 122.035 1.824 . . . . 0.0 111.596 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 6.0 t-105 -114.83 99.18 7.29 Favored 'General case' 0 N--CA 1.413 -2.298 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.289 -2.064 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.093 -177.535 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.712 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.493 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 8.9 p-10 -154.38 12.28 0.41 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.093 0.473 . . . . 0.0 111.114 -178.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -119.03 138.37 52.89 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.252 0.549 . . . . 0.0 110.097 -175.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.605 ' HB3' ' HB2' ' A' ' 8' ' ' GLN . 2.9 mm? -131.31 175.29 9.25 Favored 'General case' 0 N--CA 1.416 -2.156 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.437 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 25.0 p -79.96 160.89 25.78 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -62.19 -31.4 71.91 Favored 'General case' 0 C--O 1.203 -1.375 0 C-N-CA 121.218 -0.193 . . . . 0.0 110.754 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 11' ' ' GLU . 1.8 mp0 -63.41 -42.34 98.76 Favored 'General case' 0 C--N 1.314 -0.974 0 O-C-N 123.5 0.5 . . . . 0.0 111.057 177.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.605 ' HB2' ' HB3' ' A' ' 4' ' ' LEU . 27.6 mm-40 -64.67 -47.9 76.73 Favored 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.8 mt -56.8 -39.33 63.58 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.31 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.4 89.58 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 123.521 0.728 . . . . 0.0 111.069 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 7' ' ' GLU . 60.2 mm-40 -61.85 -44.34 97.03 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.554 0.692 . . . . 0.0 109.444 176.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -68.28 -29.76 68.62 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.444 -178.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -68.42 -33.54 74.39 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.982 175.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -68.49 -50.03 55.36 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.7 -43.09 72.2 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.771 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.41 ' HZ ' ' C ' ' A' ' 25' ' ' GLY . 70.2 t80 -59.17 -44.0 92.14 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.777 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.5 m -74.52 -20.87 59.81 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.733 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.256 2.9 tm? -68.67 -50.65 49.38 Favored 'General case' 0 CA--C 1.483 -1.63 0 N-CA-C 106.198 -1.779 . . . . 0.0 106.198 175.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.469 ' CZ ' HD23 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -77.39 -41.1 41.35 Favored 'General case' 0 N--CA 1.383 -3.809 0 CA-C-N 111.616 -2.538 . . . . 0.0 111.62 -167.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -69.97 96.28 1.02 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -74.13 -36.95 64.22 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.192 -0.913 . . . . 0.0 113.291 -174.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -93.08 -13.57 28.4 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.231 -177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.07 57.4 8.64 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 121.313 -0.47 . . . . 0.0 113.593 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -113.74 -11.96 12.84 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 116.913 0.356 . . . . 0.0 111.053 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.41 ' C ' ' HZ ' ' A' ' 16' ' ' PHE . . . 102.66 5.75 47.73 Favored Glycine 0 N--CA 1.43 -1.704 0 C-N-CA 119.833 -1.175 . . . . 0.0 113.118 -178.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.434 HG22 ' HA ' ' A' ' 64' ' ' ASP . 24.0 p -145.57 156.39 43.66 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 117.721 0.761 . . . . 0.0 111.011 173.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 72.5 mt -107.56 109.12 27.04 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.6 p -84.96 167.93 15.44 Favored 'General case' 0 C--N 1.288 -2.072 0 O-C-N 122.202 -0.312 . . . . 0.0 110.962 -178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -56.56 -34.36 67.03 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 123.304 0.642 . . . . 0.0 111.226 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -59.65 -42.15 92.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.819 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -70.25 -33.31 71.46 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.933 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.568 HD11 HG13 ' A' ' 52' ' ' ILE . 65.2 mt -56.25 -59.73 4.52 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 174.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.14 -26.8 64.1 Favored Glycine 0 C--O 1.19 -2.652 0 CA-C-N 114.599 -1.182 . . . . 0.0 112.968 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.4 m -65.24 -53.55 42.66 Favored 'General case' 0 CA--C 1.558 1.286 0 CA-C-N 117.734 0.767 . . . . 0.0 110.705 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.1 m -72.27 -32.56 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.32 0.581 . . . . 0.0 109.861 -178.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.421 ' SD ' ' HB3' ' A' ' 32' ' ' LEU . 66.9 mtp -72.33 -29.24 63.64 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.589 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -68.15 -36.12 79.15 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 175.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -63.43 -27.46 69.3 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.02 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.565 HD11 ' HD2' ' B' ' 91' ' ' LYS . 4.6 mm? -85.51 -13.54 48.71 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.105 0.478 . . . . 0.0 111.052 177.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.14 16.81 36.74 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.153 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -106.16 130.56 54.02 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -124.38 83.99 56.84 Favored Pre-proline 0 C--N 1.3 -1.545 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.965 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.559 ' HG2' HD21 ' A' ' 48' ' ' LEU . 6.2 Cg_endo -85.73 164.55 10.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.46 2.107 . . . . 0.0 111.117 173.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.0 p -86.9 169.13 12.78 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 120.932 0.396 . . . . 0.0 111.349 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -58.71 -45.58 89.24 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 125.275 1.43 . . . . 0.0 110.229 -176.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.88 95.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.512 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.435 ' O ' ' HG3' ' A' ' 51' ' ' MET . 40.0 mt-10 -61.67 -47.22 86.34 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.006 0.432 . . . . 0.0 110.128 178.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.559 HD21 ' HG2' ' A' ' 43' ' ' PRO . 95.8 mt -64.82 -38.39 90.82 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.755 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -61.1 -46.05 92.21 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.993 176.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -62.8 -39.93 95.79 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 123.37 0.419 . . . . 0.0 111.241 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.435 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 67.9 mtt -60.78 -45.76 93.11 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.024 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.568 HG13 HD11 ' A' ' 32' ' ' LEU . 23.4 mt -73.48 -36.81 49.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.77 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.403 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.6 t30 -57.9 -22.46 48.58 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 123.086 0.554 . . . . 0.0 112.346 -176.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -64.09 -32.82 74.52 Favored 'General case' 0 N--CA 1.386 -3.651 0 C-N-CA 124.261 1.024 . . . . 0.0 111.398 176.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.482 ' CG1' ' HB2' ' A' ' 71' ' ' MET . 10.9 m -107.53 -22.81 4.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-O 121.259 0.552 . . . . 0.0 110.086 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.475 ' HB2' HG22 ' A' ' 52' ' ' ILE . 42.3 t0 -73.08 116.02 13.11 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.48 -174.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.4 -16.07 38.38 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.673 177.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -88.88 -11.08 45.65 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.081 -175.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 56.32 29.79 57.29 Favored Glycine 0 CA--C 1.525 0.664 0 CA-C-N 115.479 -0.782 . . . . 0.0 113.354 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 37.2 p30 -116.33 -12.8 11.07 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 108.78 24.69 5.98 Favored Glycine 0 N--CA 1.44 -1.068 0 C-N-CA 119.489 -1.339 . . . . 0.0 113.582 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.3 p -120.24 131.6 55.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 117.581 0.691 . . . . 0.0 111.814 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.9 mt -94.67 110.21 23.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 170.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.434 ' HA ' HG22 ' A' ' 26' ' ' THR . 5.1 m-20 -90.98 158.01 16.96 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 178.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.435 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 21.9 t80 -55.8 -47.84 97.86 Favored Pre-proline 0 CA--C 1.555 1.172 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -176.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.435 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.5 Cg_endo -50.28 -44.6 37.92 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.607 2.205 . . . . 0.0 112.173 172.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -67.08 -42.3 84.88 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.752 0.421 . . . . 0.0 110.219 -179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.463 ' CE1' ' HA ' ' B' ' 100' ' ' ALA . 0.5 OUTLIER -56.51 -50.41 71.88 Favored 'General case' 0 C--O 1.244 0.79 0 C-N-CA 124.358 1.063 . . . . 0.0 109.55 176.352 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.4 mt -61.04 -40.75 94.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.764 178.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.493 ' HA ' ' HA ' ' A' ' 2' ' ' ASP . 45.0 m -59.26 -48.01 83.22 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.566 177.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.482 ' HB2' ' CG1' ' A' ' 55' ' ' VAL . 29.9 ttp -57.89 -49.99 74.84 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.938 178.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 24.4 mmt -67.39 -43.42 81.39 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 120.252 -0.579 . . . . 0.0 112.43 -176.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 77' ' ' LYS . . . -60.48 -31.36 70.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.041 0.448 . . . . 0.0 111.216 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -80.75 -40.89 24.41 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-O 121.023 0.439 . . . . 0.0 110.871 176.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -77.99 -38.07 45.8 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.146 0.498 . . . . 0.0 110.444 -169.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 46.7 mtm -83.17 -26.94 30.43 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.048 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 73' ' ' ALA . 67.1 mttm -124.84 -82.41 0.64 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -174.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -100.34 84.06 2.74 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 -170.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 93.4 m 165.41 57.87 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 129.885 3.274 . . . . 0.0 105.516 172.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 62.45 92.01 0.06 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.961 -177.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.2 t -71.45 -20.18 62.13 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.932 -172.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.412 ' H ' ' CD ' ' A' ' 82' ' ' GLU . 0.4 OUTLIER -90.72 1.98 56.38 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -64.35 -42.48 96.22 Favored 'General case' 0 CA--C 1.507 -0.691 0 C-N-CA 120.074 -0.65 . . . . 0.0 110.126 172.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -58.07 -40.11 80.22 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.887 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 44.9 mm -67.4 -44.51 86.93 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.172 -177.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -71.7 -39.78 69.96 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.491 -178.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -64.82 -40.66 95.56 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 120.827 0.346 . . . . 0.0 110.876 177.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.466 ' HB1' HD12 ' B' ' 89' ' ' ILE . . . -68.02 -35.94 79.13 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.241 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -65.62 -48.58 71.75 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -55.42 -32.63 62.84 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 179.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 13.8 p -74.62 -28.84 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.334 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.439 ' O ' ' HG2' ' A' ' 104' ' ' GLU . 88.3 m-85 -89.19 -35.56 16.15 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.417 0.627 . . . . 0.0 110.23 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -88.82 69.31 8.63 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 174.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -66.6 -34.51 78.04 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 113.821 -1.536 . . . . 0.0 112.771 -171.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -90.22 -7.18 54.18 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.422 0.629 . . . . 0.0 110.476 -176.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.06 55.91 6.78 Favored Glycine 0 CA--C 1.502 -0.764 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -104.19 -18.59 14.44 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.973 0.416 . . . . 0.0 110.181 -175.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.9 10.56 66.58 Favored Glycine 0 N--CA 1.436 -1.36 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.036 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -156.32 141.49 17.38 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 120.851 0.357 . . . . 0.0 110.739 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.487 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.1 mt -97.49 137.02 26.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.241 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 61.9 p -114.99 158.16 22.44 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.496 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.405 ' HB1' HG23 ' A' ' 121' ' ' VAL . . . -66.45 -34.84 78.84 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 121.075 0.464 . . . . 0.0 109.879 178.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.89 -52.01 67.27 Favored 'General case' 0 C--O 1.247 0.929 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.859 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.697 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 41.1 tp10 -65.61 -43.3 90.03 Favored 'General case' 0 CA--C 1.482 -1.636 0 C-N-CA 120.424 -0.51 . . . . 0.0 111.554 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.488 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.1 tt -57.38 -39.28 75.72 Favored 'General case' 0 N--CA 1.423 -1.814 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 -173.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.615 ' HG3' HG21 ' A' ' 121' ' ' VAL . 52.8 mtp180 -65.77 -34.66 78.69 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 173.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.697 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 30.7 m170 -58.98 -55.57 33.46 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.669 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -64.81 -37.74 80.95 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.392 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.732 -176.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.488 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.2 mmt -60.3 -37.94 82.12 Favored 'General case' 0 C--O 1.251 1.149 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 65.1 m -62.25 -40.58 96.67 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.18 177.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.95 -17.06 53.94 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.251 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.669 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 97.2 mt -92.18 -14.1 29.59 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 121.2 0.524 . . . . 0.0 111.83 -176.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 82.2 6.1 89.08 Favored Glycine 0 N--CA 1.437 -1.274 0 C-N-CA 120.272 -0.966 . . . . 0.0 111.418 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.41 ' HB2' ' SD ' ' A' ' 109' ' ' MET . 47.2 mm-40 -73.2 -44.08 60.33 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 67.1 mttm 57.58 90.74 0.04 OUTLIER 'General case' 0 C--O 1.242 0.668 0 O-C-N 124.763 1.29 . . . . 0.0 111.026 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.427 HD22 ' HG2' ' A' ' 120' ' ' GLU . 76.4 mt -125.89 131.28 52.38 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 -178.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 17.5 p -83.05 176.89 8.88 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.638 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -60.22 -27.74 67.44 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -172.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -68.75 -51.3 42.67 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 118.825 0.739 . . . . 0.0 111.011 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.427 ' HG2' HD22 ' A' ' 116' ' ' LEU . 7.2 tp10 -58.19 -49.78 75.83 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.945 -177.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.615 HG21 ' HG3' ' A' ' 106' ' ' ARG . 4.3 m -69.99 -29.03 38.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.845 -176.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -65.08 -46.95 79.02 Favored 'General case' 0 CA--C 1.485 -1.52 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -63.17 -36.73 84.59 Favored 'General case' 0 N--CA 1.443 -0.79 0 O-C-N 124.157 0.911 . . . . 0.0 109.79 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.9 mtt -59.88 -49.83 76.16 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.14 176.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 47.3 mm -69.03 -54.0 22.7 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.47 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.29 -178.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -57.15 -41.2 78.69 Favored 'General case' 0 C--N 1.309 -1.167 0 C-N-CA 124.806 1.242 . . . . 0.0 112.802 -172.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -81.87 -21.82 37.25 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.925 -0.71 . . . . 0.0 111.698 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -80.08 -36.45 35.5 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 176.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -61.83 104.44 0.45 Allowed 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 125.707 1.603 . . . . 0.0 109.221 175.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 72.1 mt -83.28 -45.25 18.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.65 -175.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -82.26 -11.01 58.91 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.879 -0.601 . . . . 0.0 112.29 -170.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.18 53.95 3.73 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.718 177.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -115.68 -17.59 11.06 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 121.566 0.698 . . . . 0.0 110.435 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.86 9.85 62.07 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -144.95 125.97 14.53 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.487 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.0 OUTLIER -90.56 117.9 34.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 123.455 0.472 . . . . 0.0 111.702 -178.362 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -84.79 175.66 9.01 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.5 178.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.541 ' O ' HG13 ' A' ' 142' ' ' VAL . 84.2 t80 -62.3 -43.26 99.24 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.709 -177.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -63.77 -21.99 66.69 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -87.78 -35.62 17.76 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -72.98 -36.66 67.13 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.72 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.541 HG13 ' O ' ' A' ' 138' ' ' TYR . 33.8 m -59.48 -35.44 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-O 120.995 0.426 . . . . 0.0 111.7 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -70.51 -29.62 66.18 Favored 'General case' 0 C--O 1.205 -1.241 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.977 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 73.2 mtp -57.78 -40.38 79.71 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 122.794 0.438 . . . . 0.0 112.09 -177.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 51.8 tpp -74.04 -29.46 61.92 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.22 0.533 . . . . 0.0 110.555 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 8.2 m -80.72 -23.48 39.46 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.777 0.798 . . . . 0.0 108.978 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -109.62 33.27 4.45 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.419 -177.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.4 tttm . . . . . 0 C--N 1.288 -2.104 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 -179.32 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 17.6 m . . . . . 0 N--CA 1.442 -0.86 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.05 119.29 5.01 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.626 2.217 . . . . 0.0 112.171 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -78.87 -74.77 0.26 Allowed 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 175.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -146.71 17.29 1.28 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 174.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -75.67 -20.63 58.3 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 112.618 -2.083 . . . . 0.0 109.949 -176.074 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -121.33 125.26 46.57 Favored 'General case' 0 N--CA 1.411 -2.4 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -178.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -108.99 19.85 19.1 Favored 'General case' 0 C--N 1.281 -2.411 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -41.27 -52.16 3.46 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 127.732 2.413 . . . . 0.0 112.897 -177.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -67.75 -38.21 83.16 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.644 -174.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -82.42 -37.22 25.81 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.96 -47.55 85.91 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.728 0.642 . . . . 0.0 109.679 176.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.643 ' O ' HG12 ' B' ' 89' ' ' ILE . 38.8 m95 -63.71 -43.12 97.53 Favored 'General case' 0 C--O 1.199 -1.573 0 CA-C-O 119.415 -0.326 . . . . 0.0 111.486 175.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -53.09 -51.75 60.82 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.87 0.843 . . . . 0.0 109.191 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -58.24 -45.66 87.35 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 113.43 -1.714 . . . . 0.0 109.595 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.25 -49.4 75.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.13 178.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.643 HG12 ' O ' ' B' ' 85' ' ' TRP . 51.8 mm -57.71 -51.44 70.17 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.468 0 C-N-CA 123.347 0.659 . . . . 0.0 109.312 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -61.8 -28.94 69.82 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.239 -177.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.565 ' HD2' HD11 ' A' ' 39' ' ' LEU . 4.5 tppp? -81.71 -53.29 6.34 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 120.983 0.421 . . . . 0.0 110.975 175.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.93 -44.89 68.69 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -174.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -79.84 4.55 16.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.801 0.81 . . . . 0.0 110.222 -175.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.438 ' CG ' ' HA ' ' B' ' 99' ' ' TRP . 25.1 m170 -116.92 19.21 14.47 Favored 'General case' 0 CA--C 1.489 -1.392 0 O-C-N 121.814 -0.553 . . . . 0.0 111.831 178.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.47 ' HB2' ' HD3' ' B' ' 96' ' ' PRO . 67.5 mtm -75.01 -52.4 3.25 Favored Pre-proline 0 N--CA 1.435 -1.209 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.922 172.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.47 ' HD3' ' HB2' ' B' ' 95' ' ' MET . 23.6 Cg_endo -101.66 13.88 0.38 Allowed 'Trans proline' 0 C--N 1.383 2.347 0 C-N-CA 121.844 1.696 . . . . 0.0 112.29 177.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -138.62 128.85 14.97 Favored Pre-proline 0 C--N 1.315 -0.928 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 -175.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -46.97 117.68 2.31 Favored 'Trans proline' 0 C--O 1.244 0.818 0 C-N-CA 123.594 2.863 . . . . 0.0 113.622 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . 0.438 ' HA ' ' CG ' ' B' ' 94' ' ' HIS . 2.0 t90 -64.97 -32.64 74.47 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.161 175.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . 0.463 ' HA ' ' CE1' ' A' ' 68' ' ' PHE . . . . . . . . 0 N--CA 1.389 -3.491 0 N-CA-C 103.776 -2.676 . . . . 0.0 103.776 -178.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.395 0 N-CA-C 110.984 -0.006 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 72.59 -68.91 0.21 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 125.3 1.44 . . . . 0.0 112.371 173.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.489 ' HA ' ' OE1' ' A' ' 3' ' ' GLN . 10.7 mm-40 54.76 74.88 0.33 Allowed 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 126.109 1.764 . . . . 0.0 113.514 -177.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.448 ' HB3' HD11 ' A' ' 9' ' ' ILE . 14.4 tp -110.88 138.91 46.7 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.41 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 10.0 p -68.15 142.87 55.61 Favored 'General case' 0 N--CA 1.424 -1.726 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.632 178.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -59.18 -33.29 70.77 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 123.936 0.894 . . . . 0.0 112.481 -171.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 11' ' ' GLU . 34.2 tt0 -66.38 -41.5 89.32 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.23 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.41 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 12.3 mm100 -67.69 -40.66 84.35 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.576 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 63.5 mt -58.12 -41.38 80.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.926 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.49 95.53 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 121.51 0.671 . . . . 0.0 110.921 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 7' ' ' GLU . 30.3 mt-10 -69.89 -30.96 68.52 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.727 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -75.71 -23.77 56.13 Favored 'General case' 0 C--O 1.189 -2.1 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.979 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.576 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -63.38 -46.75 85.03 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 120.838 0.351 . . . . 0.0 110.762 176.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -68.34 -40.06 81.71 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.132 -0.627 . . . . 0.0 111.529 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.04 -38.91 89.56 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-O 121.226 0.536 . . . . 0.0 109.803 178.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -60.06 -46.57 89.1 Favored 'General case' 0 C--O 1.2 -1.548 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.982 176.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.1 m -69.36 -17.2 63.66 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.374 -178.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.72 -33.48 64.38 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 176.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.553 ' CD2' HG21 ' A' ' 35' ' ' VAL . 20.4 m-85 -89.86 -38.61 13.62 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.821 178.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -80.79 97.93 7.56 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 176.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -75.1 -6.92 52.08 Favored 'General case' 0 C--N 1.288 -2.076 0 CA-C-N 115.265 -0.879 . . . . 0.0 113.223 -176.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.428 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 18.9 m-20 -102.67 -14.53 16.66 Favored 'General case' 0 C--O 1.244 0.778 0 C-N-CA 119.379 -0.928 . . . . 0.0 109.38 179.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.78 45.92 94.21 Favored Glycine 0 C--N 1.339 0.722 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -175.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.428 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 2.7 p30 -113.3 -16.24 12.54 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -173.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.23 4.79 50.25 Favored Glycine 0 C--N 1.309 -0.935 0 C-N-CA 121.149 -0.548 . . . . 0.0 113.355 178.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 79.9 p -132.92 139.32 47.29 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 117.458 0.629 . . . . 0.0 109.63 173.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.9 mt -112.04 129.82 66.82 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.8 p -99.28 174.58 6.23 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.908 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.4 p -66.18 -31.25 71.97 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 121.611 0.72 . . . . 0.0 109.866 176.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -61.56 -50.62 71.91 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.439 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.32 -42.91 92.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.817 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.0 mt -56.78 -53.37 58.56 Favored 'General case' 0 C--O 1.22 -0.452 0 O-C-N 123.573 0.546 . . . . 0.0 111.273 177.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.74 -37.43 94.35 Favored Glycine 0 C--O 1.226 -0.364 0 C-N-CA 120.201 -0.999 . . . . 0.0 112.837 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 70.3 m -62.69 -46.19 89.27 Favored 'General case' 0 C--O 1.25 1.114 0 CA-C-N 116.948 0.374 . . . . 0.0 111.339 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.553 HG21 ' CD2' ' A' ' 19' ' ' PHE . 32.9 m -71.17 -34.05 53.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 C-N-CA 120.164 -0.614 . . . . 0.0 110.56 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.645 ' HB3' ' O ' ' A' ' 41' ' ' GLN . 62.1 mtt -66.99 -36.04 81.28 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.418 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -62.34 -41.31 98.47 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.288 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.9 m -67.68 -27.4 66.81 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.998 176.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 97.4 mt -82.47 -10.5 59.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.803 0.335 . . . . 0.0 111.125 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.83 24.65 48.6 Favored Glycine 0 N--CA 1.439 -1.148 0 C-N-CA 121.169 -0.539 . . . . 0.0 112.815 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.645 ' O ' ' HB3' ' A' ' 36' ' ' MET . 48.5 tt0 -155.23 100.26 2.14 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -122.26 92.59 48.89 Favored Pre-proline 0 C--N 1.304 -1.402 0 C-N-CA 119.265 -0.974 . . . . 0.0 113.443 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.557 ' HD2' ' SD ' ' A' ' 36' ' ' MET . 50.2 Cg_exo -56.8 161.62 9.97 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 123.404 2.736 . . . . 0.0 111.695 171.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.484 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 19.1 p -74.6 160.25 31.1 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -176.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -51.9 -44.45 63.8 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 124.175 0.99 . . . . 0.0 112.613 -177.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.69 76.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.062 0.458 . . . . 0.0 110.962 -178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 51' ' ' MET . 39.9 mm-40 -72.78 -42.75 63.61 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.45 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 44' ' ' THR . 79.2 mt -62.63 -39.53 94.14 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.549 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.9 tp60 -67.22 -35.15 78.99 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.732 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.19 -39.17 78.84 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 123.285 0.366 . . . . 0.0 110.128 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.563 ' SD ' ' HA ' ' B' ' 97' ' ' ASP . 61.5 mtt -57.09 -47.31 81.34 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.027 174.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.9 mt -59.45 -50.35 80.24 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.247 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.445 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 12.1 t30 -63.04 -15.69 57.34 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -173.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -71.16 -39.24 72.05 Favored 'General case' 0 N--CA 1.384 -3.732 0 O-C-N 121.759 -0.588 . . . . 0.0 110.275 175.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.409 HG11 ' SD ' ' A' ' 71' ' ' MET . 26.0 m -99.57 -20.69 5.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.307 -177.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.445 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 46.7 t0 -68.04 99.3 0.85 Allowed 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.258 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.45 -29.68 22.63 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.799 -173.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -91.03 -9.79 44.56 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.967 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 66.94 46.77 70.49 Favored Glycine 0 N--CA 1.441 -0.987 0 CA-C-N 115.399 -0.819 . . . . 0.0 113.255 174.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -101.91 -9.43 20.7 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.308 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.84 -6.3 43.89 Favored Glycine 0 N--CA 1.44 -1.053 0 C-N-CA 120.537 -0.839 . . . . 0.0 113.596 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.8 p -130.01 161.71 30.34 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-N 117.489 0.645 . . . . 0.0 110.991 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 26' ' ' THR . 29.1 mt -99.05 119.37 46.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.576 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 7.4 t0 -89.27 161.72 16.24 Favored 'General case' 0 C--N 1.292 -1.922 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 175.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.407 ' CZ ' HD21 ' A' ' 69' ' ' LEU . 54.7 t80 -53.53 -53.58 55.28 Favored Pre-proline 0 CA--C 1.569 1.702 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -176.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.576 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 8.7 Cg_endo -50.76 -38.45 56.65 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 123.224 2.616 . . . . 0.0 113.603 174.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -69.62 -37.43 76.83 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.796 0.808 . . . . 0.0 109.688 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -67.63 -39.07 84.66 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.327 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.407 HD21 ' CZ ' ' A' ' 65' ' ' PHE . 78.2 mt -62.68 -39.72 94.87 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.492 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.7 m -56.07 -48.34 76.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.301 0.572 . . . . 0.0 109.634 176.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.525 ' HE3' ' HB2' ' B' ' 98' ' ' PRO . 28.3 ttp -60.67 -42.47 97.15 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.596 179.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.404 ' O ' ' HB3' ' A' ' 75' ' ' LYS . 20.9 mmt -73.98 -36.18 64.53 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.26 -41.05 97.12 Favored 'General case' 0 C--O 1.21 -1.005 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 175.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 58.6 mtp180 -63.06 -30.03 71.28 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.346 175.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 72' ' ' MET . 37.3 ttmt -63.78 -41.03 98.03 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 121.151 0.5 . . . . 0.0 109.934 178.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.5 mtm -102.23 13.42 34.71 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.564 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -131.36 -73.97 0.53 Allowed 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.354 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -91.17 61.11 4.44 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 122.214 1.007 . . . . 0.0 110.594 -176.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 69.6 m -158.86 129.06 5.86 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 104.818 -2.29 . . . . 0.0 104.818 176.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.83 -31.85 73.05 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.297 0.57 . . . . 0.0 109.545 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.558 ' O ' HG12 ' A' ' 85' ' ' ILE . 37.2 m 83.58 -10.3 0.97 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 168.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -57.05 -44.76 83.32 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.637 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 2.2 mp0 -46.87 -57.31 5.06 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 125.757 1.623 . . . . 0.0 110.348 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.59 -45.87 70.86 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.421 -175.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.558 HG12 ' O ' ' A' ' 81' ' ' SER . 19.8 mm -73.67 -35.7 44.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 120.704 0.287 . . . . 0.0 111.393 -174.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -74.68 -32.42 62.2 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -62.04 -45.45 93.51 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 176.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.401 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -67.02 -38.66 86.34 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 113.964 -1.471 . . . . 0.0 111.261 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -66.4 -41.67 88.98 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.3 tpm_? -53.87 -40.46 66.56 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 111.284 177.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.401 HG12 ' O ' ' A' ' 88' ' ' ALA . 11.6 p -75.58 -29.2 20.5 Favored 'Isoleucine or valine' 0 C--O 1.246 0.911 0 CA-C-O 120.917 0.389 . . . . 0.0 111.188 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -77.32 -62.71 1.57 Allowed 'General case' 0 C--O 1.21 -1.008 0 C-N-CA 119.689 -0.805 . . . . 0.0 111.084 178.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -85.84 94.75 9.23 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.764 0.792 . . . . 0.0 111.704 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.49 ' HZ1' ' HB ' ' A' ' 108' ' ' VAL . 43.0 mttp -80.44 -17.47 51.64 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 114.912 -1.04 . . . . 0.0 113.367 -178.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -92.65 -12.23 32.12 Favored 'General case' 0 CA--C 1.499 -0.994 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -176.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.95 44.54 30.08 Favored Glycine 0 N--CA 1.444 -0.785 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -93.43 -18.48 22.29 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.0 17.32 74.91 Favored Glycine 0 C--O 1.241 0.537 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.539 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 79.3 m-85 -150.0 152.61 35.18 Favored 'General case' 0 N--CA 1.437 -1.1 0 C-N-CA 124.617 1.167 . . . . 0.0 108.437 -177.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.491 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.3 mt -109.61 131.67 59.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.303 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 174.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.5 p -110.32 156.33 20.88 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.19 -41.58 97.07 Favored 'General case' 0 C--O 1.212 -0.882 0 C-N-CA 122.685 0.394 . . . . 0.0 111.504 -178.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.62 -49.14 78.9 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 123.16 0.287 . . . . 0.0 111.035 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -56.44 -52.41 64.78 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.899 0.857 . . . . 0.0 109.7 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.487 ' O ' ' HG2' ' A' ' 109' ' ' MET . 8.0 tt -63.54 -40.52 97.21 Favored 'General case' 0 N--CA 1.413 -2.306 0 CA-C-N 113.941 -1.482 . . . . 0.0 110.192 -172.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -61.11 -43.1 99.4 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -68.98 -37.52 78.8 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.002 -178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.59 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.1 p -66.32 -29.89 48.09 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.265 0 C-N-CA 119.497 -0.881 . . . . 0.0 109.623 177.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.487 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.4 mmt -60.52 -40.11 90.26 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-O 120.646 0.26 . . . . 0.0 110.593 176.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 20.3 m -60.83 -40.23 92.0 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.936 175.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -75.4 -17.27 60.24 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.808 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 68.4 mt -98.93 -20.61 16.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.994 0.426 . . . . 0.0 110.857 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.41 11.62 47.56 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.642 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -89.18 137.11 32.62 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -177.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -118.21 90.98 3.45 Favored 'General case' 0 C--N 1.286 -2.188 0 CA-C-O 121.495 0.664 . . . . 0.0 110.258 177.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 75.9 mt -110.95 167.0 10.58 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 28.7 p -100.7 172.54 7.02 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.8 -24.94 67.96 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -67.87 -40.1 83.63 Favored 'General case' 0 N--CA 1.428 -1.547 0 C-N-CA 123.046 0.538 . . . . 0.0 110.784 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -75.49 -42.94 51.6 Favored 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 121.811 -0.556 . . . . 0.0 111.996 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 125' ' ' ILE . 14.1 m -68.39 -29.58 44.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 C-N-CA 120.285 -0.566 . . . . 0.0 109.913 -178.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -70.67 -43.67 68.64 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.324 176.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -64.2 -35.11 79.72 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.469 ' HE3' ' HB1' ' B' ' 84' ' ' ALA . 62.8 mtt -54.15 -51.26 64.85 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.151 175.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.5 mm -69.11 -59.72 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.226 -177.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -61.82 -33.53 74.3 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 -170.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.493 ' HB3' ' CE1' ' B' ' 81' ' ' PHE . 14.9 tp10 -81.08 -24.39 37.81 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 119.985 -0.686 . . . . 0.0 110.673 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.705 ' HA ' ' SD ' ' A' ' 144' ' ' MET . . . -91.93 -12.85 32.31 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 122.375 1.083 . . . . 0.0 109.768 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -78.82 72.77 5.36 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 122.819 1.295 . . . . 0.0 110.286 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.414 ' HB ' ' OE1' ' A' ' 140' ' ' GLU . 35.7 mt -82.79 -12.26 12.13 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 CA-C-N 114.291 -1.322 . . . . 0.0 107.938 174.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -79.92 -10.42 59.77 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.81 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.64 40.62 99.39 Favored Glycine 0 N--CA 1.442 -0.964 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.744 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -112.34 -16.42 12.95 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.319 0.581 . . . . 0.0 110.142 -177.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 90.99 14.32 57.91 Favored Glycine 0 C--O 1.25 1.147 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 -177.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.539 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 26.0 mt-30 -150.11 139.49 21.4 Favored 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 124.699 1.2 . . . . 0.0 107.791 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.491 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.2 p -76.23 123.99 33.54 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.139 0.495 . . . . 0.0 110.977 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -91.71 154.08 19.22 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -178.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.546 ' O ' HG13 ' A' ' 142' ' ' VAL . 82.8 t80 -57.95 -48.99 78.32 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 124.328 1.051 . . . . 0.0 110.151 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -66.71 -22.14 66.07 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.414 ' OE1' ' HB ' ' A' ' 130' ' ' ILE . 29.0 mm-40 -87.32 -37.52 17.06 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -69.21 -35.03 75.78 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.295 -178.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.546 HG13 ' O ' ' A' ' 138' ' ' TYR . 22.2 m -65.19 -31.31 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 121.173 0.511 . . . . 0.0 110.066 177.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -70.83 -48.55 53.43 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.705 ' SD ' ' HA ' ' A' ' 128' ' ' ALA . 82.7 mtp -66.59 -15.82 63.72 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.328 -178.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 57.3 tpp -78.76 -41.74 29.88 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-O 120.818 0.342 . . . . 0.0 110.199 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 11.9 t -84.18 -27.89 27.74 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.724 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -84.15 109.62 17.87 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.7 tptp . . . . . 0 C--N 1.294 -1.821 0 CA-C-O 118.647 -0.692 . . . . 0.0 109.155 -178.163 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 36.5 m . . . . . 0 N--CA 1.441 -0.902 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -54.7 -36.47 90.16 Favored 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 123.035 2.49 . . . . 0.0 113.413 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.03 135.41 48.9 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 120.727 0.298 . . . . 0.0 110.671 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -148.85 176.08 10.71 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 96.5 p -83.77 -21.13 32.29 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 173.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 36.9 t80 73.37 9.72 5.1 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.455 1.902 . . . . 0.0 110.488 177.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 47.5 m170 -73.25 -18.18 61.25 Favored 'General case' 0 C--O 1.215 -0.719 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 178.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . 0.493 ' CE1' ' HB3' ' A' ' 127' ' ' GLU . 72.6 t80 -42.18 -41.9 2.83 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 126.855 2.062 . . . . 0.0 111.516 174.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . 0.545 ' O ' ' HB2' ' B' ' 86' ' ' LYS . 64.1 tttp -61.6 -52.09 65.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.14 -177.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -76.82 -27.64 55.24 Favored 'General case' 0 C--O 1.244 0.795 0 CA-C-O 121.104 0.478 . . . . 0.0 110.595 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.469 ' HB1' ' HE3' ' A' ' 124' ' ' MET . . . -62.61 -61.35 2.49 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.582 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.548 ' O ' HG12 ' B' ' 89' ' ' ILE . 57.2 m95 -64.62 -31.05 72.1 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . 0.545 ' HB2' ' O ' ' B' ' 82' ' ' LYS . 78.8 tttt -52.98 -50.02 64.99 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 124.454 1.102 . . . . 0.0 109.866 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -76.38 -41.17 48.92 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.461 177.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' B' ' 85' ' ' TRP . . . -55.13 -59.8 4.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -177.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.548 HG12 ' O ' ' B' ' 85' ' ' TRP . 32.1 pt -68.56 -27.94 38.33 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.707 0 C-N-CA 120.389 -0.524 . . . . 0.0 111.216 -178.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' B' ' 86' ' ' LYS . 8.8 tt0 -62.81 -61.76 2.19 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -65.31 -35.19 80.24 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.285 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.02 -33.24 65.62 Favored 'General case' 0 C--O 1.247 0.926 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 25.0 tptp -63.8 -53.09 56.31 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 52.5 85.49 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.727 0 O-C-N 124.417 1.073 . . . . 0.0 110.442 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 37.1 ttm -121.07 147.82 47.49 Favored Pre-proline 0 C--N 1.298 -1.673 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.429 -172.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -80.47 -152.76 0.04 OUTLIER 'Trans proline' 0 CA--C 1.547 1.131 0 C-N-CA 122.416 2.077 . . . . 0.0 108.346 167.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . 0.563 ' HA ' ' SD ' ' A' ' 51' ' ' MET . 22.8 m-20 66.78 -178.97 0.04 OUTLIER Pre-proline 0 N--CA 1.488 1.471 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 -179.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . 0.525 ' HB2' ' HE3' ' A' ' 71' ' ' MET . 2.2 Cg_endo -83.05 76.58 3.95 Favored 'Trans proline' 0 N--CA 1.443 -1.485 0 CA-C-N 121.097 1.428 . . . . 0.0 108.576 173.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 21.1 t90 -85.62 135.8 33.64 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 113.744 -1.571 . . . . 0.0 114.716 -171.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.604 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 169.176 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.371 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.6 t70 68.66 -61.07 0.42 Allowed 'General case' 0 N--CA 1.499 1.976 0 C-N-CA 125.574 1.55 . . . . 0.0 112.829 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.466 ' HA ' ' OE1' ' A' ' 3' ' ' GLN . 15.9 mm-40 -92.18 119.11 31.51 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.122 0.487 . . . . 0.0 109.813 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 12' ' ' PHE . 10.2 tp -92.67 142.06 27.78 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.826 -174.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 21.2 p -80.81 155.95 26.38 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.816 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -57.45 -44.23 84.61 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -173.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -69.18 -34.05 74.33 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.57 -177.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -63.55 -44.14 95.01 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.495 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 29.6 mt -61.61 -33.25 56.46 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.103 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.541 179.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.13 -46.17 85.3 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-O 121.019 0.437 . . . . 0.0 110.454 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.32 -48.94 75.69 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.406 -0.815 . . . . 0.0 108.986 175.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 56.6 m-85 -71.41 -16.6 62.4 Favored 'General case' 0 C--O 1.187 -2.187 0 CA-C-N 115.324 -0.853 . . . . 0.0 113.148 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 96.0 mttt -69.12 -43.83 73.63 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-O 121.539 0.685 . . . . 0.0 109.279 173.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -71.49 -41.13 69.69 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.644 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.43 -27.96 65.72 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.332 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.435 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 26.2 t80 -64.88 -52.74 54.89 Favored 'General case' 0 C--O 1.198 -1.623 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.7 m -71.84 -16.76 62.17 Favored 'General case' 0 C--N 1.309 -1.154 0 O-C-N 123.389 0.431 . . . . 0.0 110.836 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.4 tp -65.72 -36.55 83.93 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 174.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.412 ' CE2' HG21 ' A' ' 35' ' ' VAL . 6.5 m-85 -89.4 -41.86 11.86 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.619 175.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -80.65 81.94 6.78 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-O 122.582 1.182 . . . . 0.0 109.588 176.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -75.96 -19.61 58.6 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 114.287 -1.324 . . . . 0.0 112.861 -173.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.605 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 24.7 m-20 -78.15 -14.46 59.46 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.218 178.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.18 33.37 85.01 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.605 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 6.3 p-10 -112.97 -16.24 12.71 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.939 0.399 . . . . 0.0 110.793 -176.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.28 26.33 14.25 Favored Glycine 0 N--CA 1.441 -1.002 0 N-CA-C 115.635 1.014 . . . . 0.0 115.635 176.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.3 p -141.68 130.53 23.0 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 118.233 1.017 . . . . 0.0 109.096 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 61.2 mt -91.97 115.97 32.12 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.172 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.2 p -96.21 166.78 11.57 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 123.807 0.692 . . . . 0.0 109.944 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 36.4 p -64.27 -27.34 68.97 Favored 'General case' 0 C--O 1.249 1.075 0 CA-C-O 121.216 0.532 . . . . 0.0 110.087 177.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -54.59 -56.85 14.71 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 114.971 -1.013 . . . . 0.0 108.911 174.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.67 -40.13 92.08 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.167 -1.379 . . . . 0.0 111.122 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.421 ' HB3' HD22 ' A' ' 48' ' ' LEU . 91.5 mt -56.53 -60.26 3.8 Favored 'General case' 0 C--O 1.212 -0.898 0 O-C-N 123.58 0.55 . . . . 0.0 110.49 175.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.6 -30.39 72.0 Favored Glycine 0 C--O 1.216 -1.02 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.773 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.6 m -68.98 -49.72 55.38 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.716 0.258 . . . . 0.0 110.915 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.577 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 27.1 m -66.91 -39.18 82.93 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.1 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -58.52 -45.48 88.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.532 0.52 . . . . 0.0 110.261 175.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -62.83 -35.41 79.84 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 123.255 0.622 . . . . 0.0 109.951 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.0 m -76.34 -12.93 60.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.814 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 97.4 mt -96.9 -17.68 19.99 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.169 177.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.8 32.11 9.47 Favored Glycine 0 C--N 1.311 -0.818 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.426 ' C ' HD22 ' A' ' 42' ' ' ASN . 63.7 tt0 -129.49 133.34 47.23 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.426 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -129.94 81.64 68.49 Favored Pre-proline 0 C--N 1.305 -1.363 0 O-C-N 121.034 -1.041 . . . . 0.0 113.596 -178.07 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -78.68 155.56 27.47 Favored 'Trans proline' 0 C--O 1.247 0.951 0 C-N-CA 122.13 1.887 . . . . 0.0 109.994 171.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.459 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 70.4 p -84.1 167.21 17.0 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.793 0.33 . . . . 0.0 111.757 -177.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -55.78 -45.73 78.09 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.506 1.122 . . . . 0.0 112.077 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.79 -41.98 92.38 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 120.766 0.317 . . . . 0.0 110.942 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -63.92 -48.33 77.02 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.476 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.492 ' HA ' ' HE3' ' A' ' 51' ' ' MET . 91.1 mt -59.0 -42.65 90.59 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.231 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -69.78 -41.84 74.59 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -66.33 -35.92 81.6 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.436 0.636 . . . . 0.0 109.765 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.531 ' CG ' ' HD3' ' B' ' 98' ' ' PRO . 38.7 ttm -57.35 -39.97 77.05 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.593 1.557 . . . . 0.0 110.159 177.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 59.3 mt -74.27 -49.6 31.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.499 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.17 -31.0 62.99 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.383 -0.826 . . . . 0.0 113.02 -172.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -70.64 -11.36 60.89 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.504 HG11 ' SD ' ' A' ' 71' ' ' MET . 28.4 m -119.89 -18.19 6.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 O-C-N 122.403 -0.186 . . . . 0.0 110.863 174.085 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -70.13 107.72 3.8 Favored 'General case' 0 N--CA 1.444 -0.772 0 O-C-N 123.777 0.673 . . . . 0.0 111.076 -176.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.86 -9.86 54.77 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.602 -176.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.58 -11.63 20.82 Favored 'General case' 0 CA--C 1.493 -1.244 0 C-N-CA 119.964 -0.694 . . . . 0.0 110.503 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.63 41.95 99.07 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 -174.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.9 p-10 -114.3 -11.23 12.6 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.187 0.518 . . . . 0.0 110.867 -176.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.29 15.6 55.22 Favored Glycine 0 N--CA 1.431 -1.635 0 C-N-CA 120.82 -0.705 . . . . 0.0 114.418 173.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 11.9 p -137.52 147.11 44.93 Favored 'General case' 0 C--O 1.248 1.022 0 CA-C-N 117.812 0.806 . . . . 0.0 111.628 177.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.594 HG21 ' HE2' ' A' ' 71' ' ' MET . 15.6 mt -99.68 110.53 27.05 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -84.58 -179.55 7.17 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.421 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 44.7 t80 -58.76 -53.93 61.36 Favored Pre-proline 0 C--N 1.311 -1.098 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -175.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.2 Cg_endo -52.98 -41.91 68.1 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.901 2.401 . . . . 0.0 111.757 176.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -67.25 -44.74 78.67 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.022 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.582 ' O ' ' HG2' ' A' ' 72' ' ' MET . 86.6 t80 -60.12 -41.82 93.45 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.049 0.539 . . . . 0.0 109.846 177.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.415 HD11 ' CE2' ' A' ' 65' ' ' PHE . 92.9 mt -65.09 -55.55 18.11 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.353 177.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 94.8 m -55.94 -41.43 74.63 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.417 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.594 ' HE2' HG21 ' A' ' 63' ' ' ILE . 20.0 ttp -55.65 -47.03 77.33 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.629 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.598 ' SD ' ' HA ' ' B' ' 99' ' ' TRP . 10.5 mmt -71.73 -41.31 68.66 Favored 'General case' 0 CA--C 1.486 -1.494 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.769 -176.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.5 -27.89 69.28 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.542 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -83.55 -30.59 26.94 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.453 0.644 . . . . 0.0 110.776 175.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -85.31 -3.29 58.78 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.895 0.855 . . . . 0.0 110.272 -173.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.522 ' HG3' ' O ' ' A' ' 72' ' ' MET . 61.7 mtt -77.5 91.77 3.96 Favored 'General case' 0 N--CA 1.429 -1.475 0 CA-C-O 121.947 0.88 . . . . 0.0 110.053 175.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -92.65 16.65 11.71 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -59.39 119.01 6.66 Favored 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.756 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.4 t -150.24 131.59 14.63 Favored 'General case' 0 N--CA 1.408 -2.572 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 175.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.5 t70 69.5 131.28 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.267 1.027 . . . . 0.0 111.753 -175.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.3 m -69.62 -22.0 63.52 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -173.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -102.89 -13.43 16.95 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.069 0.462 . . . . 0.0 111.049 -176.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -63.84 -33.52 75.88 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.938 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 34.3 tt0 -65.3 -31.1 72.07 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 122.106 0.955 . . . . 0.0 109.494 178.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.7 mm -81.42 -29.09 10.57 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 -175.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -78.73 -26.25 44.68 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.617 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.456 ' HB3' ' O ' ' A' ' 84' ' ' GLU . 41.2 tt0 -62.67 -54.87 32.88 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 172.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.45 -39.74 76.95 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 113.741 -1.572 . . . . 0.0 110.617 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -62.49 -46.32 88.97 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.49 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 78.5 mtm180 -68.02 -25.09 65.21 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -178.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.416 HG11 ' HB1' ' B' ' 92' ' ' ALA . 14.0 p -82.79 -19.72 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 120.196 -0.601 . . . . 0.0 110.633 178.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -91.84 -56.84 2.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -84.98 83.99 7.87 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 122.09 0.948 . . . . 0.0 109.155 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -78.84 -35.17 44.37 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.642 -177.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -72.16 -14.32 61.79 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.516 0.674 . . . . 0.0 110.581 -178.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.62 54.09 10.95 Favored Glycine 0 N--CA 1.431 -1.685 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.288 175.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -89.21 -18.56 26.85 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 121.02 0.438 . . . . 0.0 110.13 176.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.18 13.0 75.17 Favored Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -178.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.434 ' HB3' ' HG2' ' A' ' 135' ' ' GLN . 76.4 m-85 -149.7 143.21 25.32 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.552 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.8 mt -87.84 109.68 19.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.8 m -80.18 140.04 36.51 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.42 ' HB2' HG13 ' A' ' 125' ' ' ILE . . . -59.47 -39.45 83.75 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 122.48 0.312 . . . . 0.0 111.416 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.81 -50.18 74.49 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.303 0.377 . . . . 0.0 111.497 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -70.51 -38.21 74.25 Favored 'General case' 0 CA--C 1.506 -0.749 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.787 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.484 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.5 tm? -59.58 -43.89 93.5 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.497 ' HA ' HG11 ' A' ' 121' ' ' VAL . 39.2 ttt180 -61.62 -45.13 95.4 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.536 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.5 m170 -59.87 -49.4 77.85 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.671 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.583 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -64.88 -33.36 63.03 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.385 0 C-N-CA 120.134 -0.626 . . . . 0.0 110.573 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.484 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.1 mmt -61.23 -41.94 97.75 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 120.887 0.375 . . . . 0.0 111.534 179.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 61.3 m -61.0 -38.51 86.29 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.217 176.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -76.73 -22.59 53.64 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.073 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 95.1 mt -88.95 -19.71 25.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.201 0.524 . . . . 0.0 110.541 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.36 0.55 55.71 Favored Glycine 0 N--CA 1.436 -1.336 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.162 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -70.62 -38.15 73.9 Favored 'General case' 0 CA--C 1.517 -0.327 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.8 mttm 59.24 33.27 22.55 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.32 174.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.438 HD22 ' HG2' ' A' ' 120' ' ' GLU . 60.2 mt -64.52 138.25 58.3 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.621 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 36.8 p -76.91 174.42 10.6 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.857 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -63.35 -44.32 95.15 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-N 116.9 -0.136 . . . . 0.0 111.263 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.506 ' CD ' ' H ' ' A' ' 119' ' ' GLU . 1.4 mp0 -59.52 -37.6 78.76 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.438 ' HG2' HD22 ' A' ' 116' ' ' LEU . 8.1 tp10 -66.78 -55.77 13.45 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.464 -178.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.499 ' O ' HG12 ' A' ' 125' ' ' ILE . 11.4 m -64.21 -32.55 57.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.032 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -60.88 -45.74 93.39 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.688 0.795 . . . . 0.0 110.295 175.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -65.18 -43.32 92.06 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.184 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.527 ' HA ' ' CE2' ' B' ' 81' ' ' PHE . 54.1 mtt -56.54 -37.27 70.27 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.301 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.9 mm -76.22 -58.27 4.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -50.97 -44.83 60.76 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.935 1.294 . . . . 0.0 113.957 -173.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.558 ' HB3' ' CZ ' ' B' ' 81' ' ' PHE . 5.3 tp10 -83.54 -13.61 54.11 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 119.65 -0.82 . . . . 0.0 111.081 -174.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -96.76 -22.3 17.04 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.505 0.669 . . . . 0.0 109.582 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -72.7 92.53 1.56 Allowed 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.546 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.412 ' HB ' ' HG3' ' A' ' 140' ' ' GLU . 57.0 mt -82.41 -19.59 10.4 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.668 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.841 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -89.22 -12.06 41.88 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-O 121.408 0.623 . . . . 0.0 110.866 -173.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.09 36.7 60.36 Favored Glycine 0 N--CA 1.429 -1.771 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.2 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -95.3 -16.6 22.3 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.393 0.616 . . . . 0.0 109.438 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.29 13.19 82.22 Favored Glycine 0 CA--C 1.503 -0.705 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -175.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.434 ' HG2' ' HB3' ' A' ' 99' ' ' TYR . 9.4 tt0 -151.09 144.73 25.01 Favored 'General case' 0 N--CA 1.418 -2.061 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 -176.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.552 HG13 ' HB ' ' A' ' 100' ' ' ILE . 2.4 p -97.27 112.21 28.8 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.99 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -172.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.45 ' HB3' ' OE2' ' A' ' 140' ' ' GLU . 45.1 t30 -76.38 162.62 27.72 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.825 178.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -56.21 -48.3 76.69 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 123.431 0.693 . . . . 0.0 112.374 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.533 ' HA ' HG22 ' A' ' 142' ' ' VAL . 41.3 mt-10 -66.65 -41.13 88.74 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.262 0.553 . . . . 0.0 111.422 -178.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.45 ' OE2' ' HB3' ' A' ' 137' ' ' ASN . 2.8 mp0 -56.78 -45.71 81.98 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.767 174.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -64.73 -50.84 65.31 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.843 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.533 HG22 ' HA ' ' A' ' 139' ' ' GLU . 24.2 m -62.43 -37.97 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -176.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -51.68 -59.51 4.21 Favored 'General case' 0 C--O 1.233 0.237 0 O-C-N 123.986 0.804 . . . . 0.0 110.482 -177.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.72 -26.68 44.81 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -172.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 2.6 tmm? -80.78 -33.85 34.6 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.275 -0.57 . . . . 0.0 110.959 -174.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 57.6 p -87.69 2.74 50.28 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.593 0.711 . . . . 0.0 110.629 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -82.81 50.51 1.71 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.949 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm . . . . . 0 C--O 1.247 0.93 0 C-N-CA 124.995 1.318 . . . . 0.0 110.01 -177.772 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 17.3 p . . . . . 0 N--CA 1.436 -1.137 0 N-CA-C 107.262 -1.385 . . . . 0.0 107.262 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo -46.34 -44.73 19.93 Favored 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 122.844 2.363 . . . . 0.0 110.606 177.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.95 179.14 8.72 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 172.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -154.4 98.68 2.13 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 173.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 2.7 p -82.03 22.81 0.75 Allowed 'General case' 0 C--N 1.299 -1.626 0 C-N-CA 124.348 1.059 . . . . 0.0 112.971 -175.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 67.05 163.78 0.19 Allowed 'General case' 0 C--O 1.24 0.6 0 C-N-CA 124.514 1.125 . . . . 0.0 112.33 -178.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 61.2 m170 70.74 -36.14 0.35 Allowed 'General case' 0 N--CA 1.504 2.239 0 C-N-CA 125.162 1.385 . . . . 0.0 113.073 -178.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . 0.558 ' CZ ' ' HB3' ' A' ' 127' ' ' GLU . 91.2 t80 -55.35 -41.08 72.04 Favored 'General case' 0 C--N 1.315 -0.935 0 C-N-CA 124.91 1.284 . . . . 0.0 112.007 -178.085 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -71.01 -36.74 72.54 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.949 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -69.55 -31.59 69.88 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.432 0.634 . . . . 0.0 109.334 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.462 ' HA ' ' CE1' ' B' ' 87' ' ' HIS . . . -61.98 -54.92 35.04 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.14 173.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 26.9 m95 -57.68 -40.96 80.61 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.341 175.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -54.72 -58.26 8.26 Favored 'General case' 0 CA--C 1.501 -0.934 0 C-N-CA 123.45 0.7 . . . . 0.0 110.169 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . 0.462 ' CE1' ' HA ' ' B' ' 84' ' ' ALA . 2.8 p-80 -65.49 -30.85 71.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.243 -0.583 . . . . 0.0 112.465 -179.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.08 -47.67 73.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.301 0.572 . . . . 0.0 110.061 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 85.4 mt -66.47 -36.66 77.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.73 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -59.01 -45.36 90.88 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.407 ' CG ' ' HB3' ' A' ' 112' ' ' LEU . 4.0 tppp? -64.55 -43.87 92.59 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.271 175.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.416 ' HB1' HG11 ' A' ' 91' ' ' VAL . . . -61.18 -33.72 73.9 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.318 0.58 . . . . 0.0 110.983 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 22.6 mtpp -87.07 9.02 21.04 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.857 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 12.2 m80 -118.18 96.39 5.31 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.282 0.563 . . . . 0.0 111.917 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 27.5 ptm -85.27 -175.97 0.71 Allowed Pre-proline 0 C--N 1.301 -1.526 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 172.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -68.43 76.54 0.72 Allowed 'Trans proline' 0 C--N 1.352 0.712 0 CA-C-N 121.888 1.71 . . . . 0.0 110.498 172.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . 0.441 ' HA ' ' HD3' ' B' ' 98' ' ' PRO . 27.0 t70 -170.47 137.89 1.3 Allowed Pre-proline 0 C--N 1.312 -1.056 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 -177.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . 0.531 ' HD3' ' CG ' ' A' ' 51' ' ' MET . 1.3 Cg_endo -83.52 143.66 11.03 Favored 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.447 2.098 . . . . 0.0 113.413 -174.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . 0.598 ' HA ' ' SD ' ' A' ' 72' ' ' MET . 36.7 t-105 -140.72 -39.63 0.42 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 114.581 -1.19 . . . . 0.0 108.291 178.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.409 -2.523 1 N-CA-C 100.14 -4.022 . . . . 0.0 100.14 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.765 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -126.98 -39.5 1.94 Allowed 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 177.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.45 ' HA ' ' OE1' ' A' ' 3' ' ' GLN . 14.2 mm-40 -96.26 164.23 12.75 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 175.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.468 HD23 HD22 ' A' ' 69' ' ' LEU . 12.0 tp -126.68 151.44 48.09 Favored 'General case' 0 C--N 1.293 -1.874 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -174.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.9 p -82.59 152.94 25.72 Favored 'General case' 0 N--CA 1.428 -1.564 0 O-C-N 123.364 0.415 . . . . 0.0 110.9 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -53.53 -45.19 69.68 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -171.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.55 -37.91 88.09 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-O 120.733 0.301 . . . . 0.0 110.992 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.426 ' HB3' ' HE1' ' A' ' 76' ' ' MET . 5.8 mm-40 -72.76 -33.09 66.11 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.507 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 36.3 mt -66.08 -34.45 70.34 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.095 176.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.5 -37.78 80.39 Favored 'General case' 0 C--O 1.252 1.21 0 CA-C-O 121.815 0.817 . . . . 0.0 109.88 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -62.75 -40.08 96.13 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.155 176.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -79.75 -16.36 55.74 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 30.5 mmtp -61.92 -47.2 85.98 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 171.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -59.78 -52.95 63.26 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-N 114.285 -1.325 . . . . 0.0 110.327 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.94 82.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.76 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -65.78 -45.91 80.71 Favored 'General case' 0 C--O 1.206 -1.232 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.601 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 32.1 t -69.25 -23.74 63.9 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 120.732 0.301 . . . . 0.0 111.047 -177.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.292 1.0 OUTLIER -62.1 -57.03 13.09 Favored 'General case' 0 CA--C 1.476 -1.866 0 CA-C-O 123.196 1.474 . . . . 0.0 107.091 174.268 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.493 ' CZ ' HD23 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -74.43 -33.89 63.07 Favored 'General case' 1 N--CA 1.368 -4.564 0 CA-C-N 111.666 -2.515 . . . . 0.0 109.605 -167.72 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -78.19 84.38 4.41 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-O 122.235 1.017 . . . . 0.0 108.416 173.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.7 mmtm -67.75 -32.23 72.68 Favored 'General case' 0 N--CA 1.421 -1.908 0 CA-C-N 113.931 -1.486 . . . . 0.0 112.439 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -87.34 -13.48 43.44 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.919 -176.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.96 50.57 64.33 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 -177.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -113.4 -12.11 13.03 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -176.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.88 5.8 57.34 Favored Glycine 0 C--N 1.306 -1.128 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.309 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.8 p -143.04 145.62 33.07 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 117.758 0.779 . . . . 0.0 111.838 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.8 mt -95.46 118.02 40.74 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 69.6 p -100.79 169.5 8.96 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.139 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 77.8 p -63.31 -30.95 71.99 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 121.255 0.55 . . . . 0.0 109.995 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.1 tttm -50.04 -55.97 12.66 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.759 1.223 . . . . 0.0 109.348 175.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -67.65 -40.07 84.57 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.626 -176.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.493 HD23 ' CZ ' ' A' ' 19' ' ' PHE . 83.9 mt -54.17 -55.85 23.88 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.978 0.894 . . . . 0.0 109.498 177.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.76 -21.38 73.01 Favored Glycine 0 C--O 1.215 -1.093 0 CA-C-N 115.4 -0.818 . . . . 0.0 113.288 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.7 m -74.32 -48.27 29.32 Favored 'General case' 0 C--O 1.254 1.293 0 CA-C-N 117.497 0.648 . . . . 0.0 110.376 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 m -68.64 -32.81 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.463 ' HB3' ' HB3' ' A' ' 41' ' ' GLN . 41.1 mtm -73.26 -27.71 61.73 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -61.24 -39.69 91.25 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.0 m -63.46 -27.55 69.36 Favored 'General case' 0 CA--C 1.554 1.129 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.457 176.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.563 HD11 ' SD ' ' B' ' 95' ' ' MET . 2.4 tm? -88.88 -23.64 22.71 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.194 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 103.74 11.99 31.4 Favored Glycine 0 C--N 1.308 -1.026 0 C-N-CA 120.189 -1.005 . . . . 0.0 112.39 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.463 ' HB3' ' HB3' ' A' ' 36' ' ' MET . 2.4 tp-100 -101.28 125.01 47.86 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 179.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.413 HD22 ' C ' ' A' ' 41' ' ' GLN . 1.0 OUTLIER -125.87 75.26 71.2 Favored Pre-proline 0 C--N 1.294 -1.825 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.061 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.432 ' HG2' HD21 ' A' ' 48' ' ' LEU . 5.6 Cg_exo -77.64 147.91 25.39 Favored 'Trans proline' 0 N--CA 1.448 -1.164 0 C-N-CA 121.777 1.651 . . . . 0.0 109.977 176.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.5 p -68.56 154.02 42.66 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-O 120.533 0.206 . . . . 0.0 110.845 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -59.48 -30.57 68.63 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 122.801 0.44 . . . . 0.0 110.982 -177.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.27 78.54 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.338 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 51' ' ' MET . 55.2 mm-40 -65.97 -43.34 88.14 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.98 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.432 HD21 ' HG2' ' A' ' 43' ' ' PRO . 85.6 mt -67.43 -34.15 76.62 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.327 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.41 -44.77 90.19 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 178.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.56 -41.22 98.42 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.35 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 67.5 mtt -61.84 -42.53 99.14 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.084 178.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.9 mt -63.36 -45.07 99.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.998 0.428 . . . . 0.0 110.584 176.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -58.59 -18.28 28.8 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -175.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -64.82 -41.49 95.72 Favored 'General case' 0 N--CA 1.39 -3.472 0 O-C-N 121.783 -0.573 . . . . 0.0 110.051 177.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.582 HG11 ' SD ' ' A' ' 71' ' ' MET . 17.1 m -104.74 -17.33 7.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.429 -178.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -67.89 113.43 5.61 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -178.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.7 -23.73 36.61 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.229 0.537 . . . . 0.0 110.612 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -99.01 -11.89 21.1 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.399 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.52 51.55 57.12 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.642 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -115.22 -4.19 12.46 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 120.84 0.353 . . . . 0.0 111.906 -176.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.56 13.66 37.4 Favored Glycine 0 N--CA 1.438 -1.22 0 C-N-CA 120.829 -0.701 . . . . 0.0 113.299 174.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 11.2 p -141.48 139.55 33.35 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 116.882 0.341 . . . . 0.0 110.564 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.0 mt -91.47 113.25 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.941 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -83.85 166.19 18.13 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.463 ' CE2' HD11 ' A' ' 69' ' ' LEU . 56.5 t80 -56.79 -57.69 22.36 Favored Pre-proline 0 CA--C 1.555 1.145 0 O-C-N 123.568 0.543 . . . . 0.0 112.213 -177.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.17 -39.51 90.62 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.496 2.131 . . . . 0.0 112.539 177.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -63.4 -44.97 93.15 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.332 0.586 . . . . 0.0 110.287 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.63 -26.32 57.66 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.665 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.468 HD22 HD23 ' A' ' 4' ' ' LEU . 80.4 mt -63.98 -42.1 97.33 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 174.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.41 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 47.2 m -56.4 -48.69 76.4 Favored 'General case' 0 C--O 1.239 0.544 0 O-C-N 123.835 0.709 . . . . 0.0 109.152 175.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.582 ' SD ' HG11 ' A' ' 55' ' ' VAL . 40.4 ttp -54.65 -55.4 30.0 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.841 177.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 20.7 mmt -62.33 -38.62 90.16 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.4 -19.31 63.81 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 70' ' ' THR . 95.0 mtt180 -84.11 -29.86 26.42 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.23 0.538 . . . . 0.0 110.507 173.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -83.68 -33.74 25.12 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.803 0.811 . . . . 0.0 109.996 -176.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.426 ' HE1' ' HB3' ' A' ' 8' ' ' GLN . 34.9 ttm -84.42 122.67 29.29 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.842 -176.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 80.1 tttt 60.13 95.07 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.156 1.535 . . . . 0.0 111.582 171.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 79.31 123.59 0.05 OUTLIER 'General case' 0 CA--C 1.496 -1.133 0 C-N-CA 125.058 1.343 . . . . 0.0 111.73 -175.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.533 ' OG1' ' HA ' ' A' ' 82' ' ' GLU . 3.1 p -114.73 172.5 7.0 Favored 'General case' 0 C--N 1.277 -2.558 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.384 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -91.47 -44.91 8.83 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.839 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.6 m -120.22 14.26 12.13 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.297 0.57 . . . . 0.0 110.086 178.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.533 ' HA ' ' OG1' ' A' ' 79' ' ' THR . 10.6 mm-40 63.31 18.75 11.24 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.998 1.319 . . . . 0.0 110.88 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.48 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -60.34 -45.43 93.48 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.312 -1.313 . . . . 0.0 112.331 -175.715 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -59.52 -42.69 92.84 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 121.776 0.798 . . . . 0.0 110.356 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.461 HG21 HG12 ' A' ' 142' ' ' VAL . 8.0 mm -70.6 -42.87 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 CA-C-N 114.113 -1.403 . . . . 0.0 108.929 -173.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -71.16 -38.08 72.2 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.682 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.507 ' HB2' ' HE2' ' B' ' 93' ' ' LYS . 52.5 mt-10 -58.62 -46.82 86.24 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 175.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.76 -40.1 91.71 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.094 -179.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -65.44 -49.33 69.54 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.16 0.505 . . . . 0.0 109.966 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 24.5 ttp85 -58.35 -38.79 77.9 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.375 1.07 . . . . 0.0 112.432 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 9.6 p -75.97 -19.57 15.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.643 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -86.69 -50.81 6.52 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.453 174.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -95.59 76.46 3.28 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.947 0.879 . . . . 0.0 110.994 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -79.06 -29.4 43.44 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.542 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.99 -12.98 61.49 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.241 0.543 . . . . 0.0 111.457 -178.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.56 48.47 10.5 Favored Glycine 0 N--CA 1.435 -1.407 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.743 176.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -80.92 -19.91 43.24 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.23 -0.38 85.66 Favored Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 110.759 -0.937 . . . . 0.0 110.759 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.1 p90 -156.74 158.24 36.54 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -178.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.576 ' HB ' HG13 ' A' ' 136' ' ' VAL . 1.7 mt -87.41 106.09 15.84 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.3 t -93.82 143.71 26.09 Favored 'General case' 0 N--CA 1.422 -1.825 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.499 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.56 -38.99 92.93 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 123.218 0.607 . . . . 0.0 111.45 -177.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.7 -46.21 89.76 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.394 0.616 . . . . 0.0 109.981 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.581 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 2.8 tp10 -66.71 -45.64 78.08 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.392 176.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.99 -35.99 78.28 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -175.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.498 ' HB2' HG21 ' A' ' 121' ' ' VAL . 29.5 ttp180 -64.96 -36.2 83.63 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.296 177.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.581 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 42.9 m170 -56.72 -50.97 70.6 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.124 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.697 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.1 p -70.72 -33.06 51.31 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.838 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.36 -177.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 20.9 mmt -62.3 -46.72 87.48 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 15.3 m -65.23 -30.88 71.81 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.374 0.607 . . . . 0.0 109.498 177.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -71.89 -32.32 67.31 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.462 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 71.9 mt -85.47 -19.38 31.33 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-O 121.024 0.44 . . . . 0.0 110.69 -176.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.54 14.15 57.35 Favored Glycine 0 N--CA 1.434 -1.435 0 C-N-CA 120.56 -0.828 . . . . 0.0 111.606 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.428 ' OE1' ' HG3' ' B' ' 91' ' ' LYS . 30.9 mm-40 -74.48 -36.85 63.3 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 55.94 62.23 2.47 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 122.421 1.105 . . . . 0.0 110.78 178.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 71.2 mt -92.81 147.13 23.11 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.2 p -77.84 174.43 11.03 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 120.354 -0.538 . . . . 0.0 110.462 -179.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -68.37 -38.05 81.01 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.149 0.499 . . . . 0.0 109.705 -178.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 119' ' ' GLU . 1.4 mp0 -63.45 -42.49 98.64 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 177.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -61.99 -54.85 35.96 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.437 1.095 . . . . 0.0 110.53 -177.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.498 HG21 ' HB2' ' A' ' 106' ' ' ARG . 25.3 m -63.39 -36.98 78.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.002 -177.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -72.18 -32.35 66.75 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.699 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -64.2 -47.58 79.21 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 mtt -51.68 -50.47 60.36 Favored 'General case' 0 CA--C 1.503 -0.844 0 O-C-N 123.601 0.563 . . . . 0.0 110.381 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.532 ' CG2' ' HA ' ' A' ' 135' ' ' GLN . 40.4 mm -60.11 -49.46 83.99 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.538 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.143 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.4 ttm180 -65.64 -30.82 71.58 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 123.298 0.639 . . . . 0.0 111.474 -175.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -78.03 -34.03 50.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.842 0.353 . . . . 0.0 110.683 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.13 -28.12 42.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.648 0.737 . . . . 0.0 109.282 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -74.84 94.4 2.77 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.681 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.433 ' HB ' ' HG3' ' A' ' 140' ' ' GLU . 9.6 mt -82.19 -19.06 10.81 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.804 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.151 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -82.62 -11.5 58.34 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.591 -173.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.3 24.06 72.06 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.177 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -87.11 -17.08 33.65 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.44 0.638 . . . . 0.0 109.768 -177.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 97.01 -18.62 57.2 Favored Glycine 0 N--CA 1.437 -1.277 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.192 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.532 ' HA ' ' CG2' ' A' ' 125' ' ' ILE . 31.8 mt-30 -134.44 147.33 50.41 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.576 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.7 p -94.76 124.03 47.1 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -173.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -93.4 175.4 6.77 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.547 ' O ' HG13 ' A' ' 142' ' ' VAL . 73.5 t80 -60.19 -45.69 92.26 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -175.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.638 ' O ' HG22 ' A' ' 142' ' ' VAL . 35.6 mm-40 -61.59 -43.58 98.6 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.331 0.586 . . . . 0.0 111.644 -179.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.433 ' HG3' ' HB ' ' A' ' 130' ' ' ILE . 0.3 OUTLIER -68.14 -33.79 75.14 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.041 178.546 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -67.72 -38.97 84.3 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.998 176.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.638 HG22 ' O ' ' A' ' 139' ' ' GLU . 7.2 m -59.05 -38.53 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.46 -178.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -76.37 -41.46 48.01 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.617 -175.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 3.7 ppp? -76.52 -32.2 58.13 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.155 -0.618 . . . . 0.0 112.101 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.5 tpt -71.56 -26.0 62.44 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.114 0.483 . . . . 0.0 110.571 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 39.1 p -98.3 7.44 46.22 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.381 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.21 82.23 6.31 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-O 121.204 0.526 . . . . 0.0 111.275 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt . . . . . 0 N--CA 1.434 -1.269 0 CA-C-O 118.044 -0.979 . . . . 0.0 108.399 177.574 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 30.8 m . . . . . 0 N--CA 1.44 -0.964 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -71.96 -13.85 29.14 Favored 'Trans proline' 0 C--N 1.362 1.281 0 C-N-CA 123.021 2.48 . . . . 0.0 114.701 -175.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -119.69 -64.41 1.27 Allowed 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 177.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 59.5 t30 61.61 30.96 18.82 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.211 1.004 . . . . 0.0 110.212 175.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . 0.492 ' O ' ' HB3' ' B' ' 81' ' ' PHE . 32.0 t -67.76 -33.63 75.23 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.508 1.123 . . . . 0.0 112.82 -173.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -76.58 -31.62 57.63 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.384 0.612 . . . . 0.0 109.858 -178.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -77.89 -28.84 49.97 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.538 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . 0.492 ' HB3' ' O ' ' B' ' 78' ' ' SER . 46.6 t80 -53.28 -42.35 66.48 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.786 1.235 . . . . 0.0 110.723 177.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp -63.41 -47.83 80.35 Favored 'General case' 0 N--CA 1.418 -2.04 0 C-N-CA 123.217 0.607 . . . . 0.0 110.747 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -58.92 -55.49 34.42 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.481 1.134 . . . . 0.0 108.675 176.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.03 -50.99 60.33 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 112.613 -2.085 . . . . 0.0 112.263 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -72.6 -28.6 62.88 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -58.84 -55.93 28.77 Favored 'General case' 0 CA--C 1.481 -1.693 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 172.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -46.66 -58.33 3.94 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 125.113 1.508 . . . . 0.0 111.333 175.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.12 -52.85 62.85 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 45.4 mm -65.14 -49.01 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-O 120.99 0.424 . . . . 0.0 110.102 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . 0.471 ' O ' ' HB2' ' B' ' 94' ' ' HIS . 7.9 tt0 -60.92 -37.35 81.98 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.968 0.907 . . . . 0.0 112.047 -176.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.428 ' HG3' ' OE1' ' A' ' 114' ' ' GLU . 14.0 mmmm -81.73 -42.18 20.2 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' B' ' 94' ' ' HIS . . . -77.95 -51.26 10.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.074 0.464 . . . . 0.0 111.588 -177.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.507 ' HE2' ' HB2' ' A' ' 87' ' ' GLU . 58.2 tttm -77.9 10.83 2.53 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.356 1.074 . . . . 0.0 110.321 -175.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.471 ' HB2' ' O ' ' B' ' 90' ' ' GLN . 4.7 t60 -74.68 -7.6 53.75 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 125.699 1.599 . . . . 0.0 109.676 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.563 ' SD ' HD11 ' A' ' 39' ' ' LEU . 93.0 mmm -53.43 -55.74 31.62 Favored Pre-proline 0 CA--C 1.551 0.982 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.471 -179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.514 ' HD3' ' HB2' ' B' ' 95' ' ' MET . 16.1 Cg_endo -101.22 44.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.365 1.402 0 C-N-CA 122.806 2.338 . . . . 0.0 109.755 177.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 15.3 t70 74.08 135.86 0.05 OUTLIER Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 125.804 1.642 . . . . 0.0 112.097 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -75.54 -14.49 19.99 Favored 'Trans proline' 0 C--O 1.255 1.355 0 C-N-CA 122.862 2.374 . . . . 0.0 114.57 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 65.7 m95 71.23 -46.52 0.64 Allowed 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 126.378 1.871 . . . . 0.0 111.943 -176.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.92 0 C-N-CA 125.785 1.634 . . . . 0.0 107.848 175.327 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.487 0 CA-C-O 120.647 0.26 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -134.19 156.04 49.06 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -126.38 36.45 4.49 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 176.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.428 ' HB3' HD11 ' A' ' 9' ' ' ILE . 11.1 tp -72.94 140.95 47.78 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.322 -173.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.5 p -82.65 153.76 25.24 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.255 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -53.62 -44.05 69.18 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 125.018 1.327 . . . . 0.0 110.959 -176.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -55.89 -49.01 74.6 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.107 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -68.57 -47.22 67.36 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.722 -178.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.622 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 60.3 mt -57.37 -40.24 73.02 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.464 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.329 -178.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.31 -49.03 79.38 Favored 'General case' 0 C--O 1.252 1.186 0 CA-C-O 120.792 0.33 . . . . 0.0 111.4 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -60.2 -41.18 92.43 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.637 0.732 . . . . 0.0 109.578 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.494 ' CE2' ' HG2' ' A' ' 72' ' ' MET . 36.5 m-85 -77.27 -13.62 59.9 Favored 'General case' 0 C--O 1.207 -1.156 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.622 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 97.7 mttt -69.64 -43.41 72.67 Favored 'General case' 0 C--O 1.249 1.059 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 173.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -64.64 -45.45 86.76 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.014 -0.993 . . . . 0.0 110.18 176.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.454 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -58.52 -47.88 82.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.356 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -57.03 -49.15 76.7 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.336 0.655 . . . . 0.0 111.196 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.3 m -76.99 -19.61 57.08 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.234 -174.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 15' ' ' ALA . 4.5 pp -79.21 -21.98 45.52 Favored 'General case' 0 CA--C 1.502 -0.9 0 C-N-CA 118.979 -1.088 . . . . 0.0 110.741 176.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.462 ' CE2' ' HA ' ' A' ' 32' ' ' LEU . 2.7 t80 -80.7 -50.85 9.37 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.46 79.72 3.17 Favored 'General case' 0 N--CA 1.416 -2.145 0 CA-C-N 113.012 -1.904 . . . . 0.0 110.47 -178.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -54.58 -34.39 61.85 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 113.584 -1.644 . . . . 0.0 112.793 -175.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -92.87 -8.18 44.12 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.734 -170.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.5 37.12 94.02 Favored Glycine 0 C--O 1.235 0.208 0 C-N-CA 121.344 -0.455 . . . . 0.0 112.626 177.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -100.87 -16.2 17.32 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 122.755 -0.262 . . . . 0.0 111.288 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.5 6.96 76.59 Favored Glycine 0 N--CA 1.439 -1.126 0 C-N-CA 120.554 -0.831 . . . . 0.0 114.4 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.8 p -128.68 130.69 47.53 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 118.063 0.931 . . . . 0.0 109.737 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 51.2 mt -96.15 122.01 47.24 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.492 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 46.4 p -101.86 168.32 9.5 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.037 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.426 HG23 HD12 ' A' ' 52' ' ' ILE . 32.4 p -64.84 -27.74 69.08 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.131 0.491 . . . . 0.0 110.496 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -57.47 -57.16 13.87 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 177.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.49 -37.9 89.16 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 114.543 -1.208 . . . . 0.0 111.834 -176.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 28' ' ' THR . 96.4 mt -52.85 -62.84 1.39 Allowed 'General case' 0 CA--C 1.501 -0.932 0 O-C-N 124.237 0.961 . . . . 0.0 109.85 178.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.07 -28.52 71.56 Favored Glycine 0 N--CA 1.428 -1.861 0 C-N-CA 119.875 -1.155 . . . . 0.0 113.268 -176.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.3 m -60.82 -55.36 34.01 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 118.105 0.953 . . . . 0.0 111.007 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.69 -35.05 30.12 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.746 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.3 mtp -64.98 -37.29 87.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.419 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -64.85 -40.77 95.68 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 122.703 0.401 . . . . 0.0 110.027 176.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.4 m -65.4 -26.82 68.16 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.371 0.605 . . . . 0.0 110.339 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.423 ' HB3' ' HE3' ' B' ' 91' ' ' LYS . 4.6 mm? -94.72 8.98 40.68 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.785 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.447 ' HA3' ' HA3' ' A' ' 113' ' ' GLY . . . 87.03 35.54 9.72 Favored Glycine 0 C--N 1.312 -0.786 0 C-N-CA 120.032 -1.08 . . . . 0.0 115.719 172.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -143.16 121.78 12.53 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 172.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.442 HD22 ' N ' ' A' ' 42' ' ' ASN . 0.7 OUTLIER -116.06 84.49 13.71 Favored Pre-proline 0 C--N 1.309 -1.183 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.723 -178.884 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.657 ' HG2' HD21 ' A' ' 48' ' ' LEU . 19.1 Cg_endo -84.47 169.22 11.07 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.386 2.058 . . . . 0.0 111.655 176.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.0 p -96.48 170.3 9.31 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.848 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -56.49 -42.48 78.36 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.55 1.14 . . . . 0.0 110.368 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.24 -47.77 84.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.364 -178.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -63.73 -43.69 95.74 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.361 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.657 HD21 ' HG2' ' A' ' 43' ' ' PRO . 94.1 mt -62.7 -34.09 76.42 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.709 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -72.58 -34.39 67.42 Favored 'General case' 0 N--CA 1.44 -0.932 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.69 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -65.68 -42.26 91.46 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.2 mtt -55.28 -42.84 74.1 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.655 177.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.426 HD12 HG23 ' A' ' 29' ' ' THR . 33.3 mt -71.16 -56.52 10.27 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.612 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.815 176.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -54.22 -31.04 52.15 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -174.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.94 -42.5 89.96 Favored 'General case' 0 N--CA 1.415 -2.19 0 C-N-CA 124.009 0.924 . . . . 0.0 110.744 175.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.55 HG11 ' SD ' ' A' ' 71' ' ' MET . 9.5 m -102.84 -18.9 6.37 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.194 -175.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -68.63 109.7 3.9 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.56 -40.33 21.06 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.041 -173.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -94.44 -9.91 34.07 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.143 -176.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 65.88 53.24 31.83 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.977 177.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.2 p-10 -107.6 -9.71 15.82 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 120.65 -0.42 . . . . 0.0 111.241 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 106.95 -0.05 35.94 Favored Glycine 0 N--CA 1.439 -1.159 0 C-N-CA 120.386 -0.911 . . . . 0.0 113.306 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.5 p -135.27 151.33 50.47 Favored 'General case' 0 C--O 1.249 1.068 0 CA-C-N 117.609 0.705 . . . . 0.0 111.888 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.1 mt -93.71 110.34 23.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 175.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -82.49 175.11 10.47 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 177.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.448 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 59.8 t80 -61.08 -52.9 68.56 Favored Pre-proline 0 C--N 1.302 -1.487 0 CA-C-O 119.255 -0.403 . . . . 0.0 111.484 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -53.02 -34.94 69.89 Favored 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.769 2.313 . . . . 0.0 112.522 174.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -74.39 -39.87 62.4 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -61.85 -42.54 99.17 Favored 'General case' 0 C--O 1.246 0.889 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 76.3 mt -60.47 -46.55 89.66 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.022 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.2 m -57.89 -42.22 84.18 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 123.52 0.512 . . . . 0.0 110.853 177.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.55 ' SD ' HG11 ' A' ' 55' ' ' VAL . 30.6 ttp -57.79 -45.92 85.35 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 121.021 0.439 . . . . 0.0 111.451 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.494 ' HG2' ' CE2' ' A' ' 12' ' ' PHE . 34.6 tpp -76.3 -33.74 59.06 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.222 -176.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.35 -21.73 62.0 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.745 -179.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -83.64 -27.49 29.09 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 121.549 0.69 . . . . 0.0 109.663 173.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -86.39 -38.66 17.17 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.302 -173.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.411 ' HG2' ' OE1' ' A' ' 84' ' ' GLU . 32.5 mtm -99.11 -30.81 12.09 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.99 -178.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.413 ' HG2' ' H ' ' A' ' 78' ' ' ASP . 43.3 tttp -119.34 176.59 5.26 Favored 'General case' 0 N--CA 1.414 -2.268 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 -172.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.413 ' H ' ' HG2' ' A' ' 77' ' ' LYS . 35.9 t70 67.32 20.37 10.03 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 123.676 1.703 . . . . 0.0 108.33 -174.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.5 t -163.43 127.39 2.82 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-N 112.901 -1.954 . . . . 0.0 107.394 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -118.12 -25.08 6.77 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -173.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.9 m -88.42 71.65 8.99 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -171.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 53.63 41.99 31.96 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 114.082 -1.417 . . . . 0.0 113.183 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -60.46 -62.73 1.65 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.411 ' OE1' ' HG2' ' A' ' 76' ' ' MET . 45.3 mt-10 -67.04 -35.09 79.12 Favored 'General case' 0 CA--C 1.485 -1.539 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.315 -178.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.407 ' CG2' HG12 ' A' ' 142' ' ' VAL . 26.8 mm -61.13 -46.02 97.44 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.408 -176.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.1 ttp-105 -67.97 -50.16 57.37 Favored 'General case' 0 C--O 1.196 -1.745 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.032 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -55.49 -39.2 70.12 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.08 -39.5 86.81 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 120.501 0.191 . . . . 0.0 111.132 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -71.57 -49.15 43.28 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -56.59 -32.5 65.29 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 126.521 1.929 . . . . 0.0 112.485 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.52 -28.63 16.11 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 C-N-CA 120.197 -0.601 . . . . 0.0 111.304 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -81.6 -47.64 12.78 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 174.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -83.84 61.74 6.55 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 122.974 1.369 . . . . 0.0 107.452 175.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -77.84 -24.03 48.76 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.415 -172.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -93.49 -13.34 27.97 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.497 0.665 . . . . 0.0 110.359 -177.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.2 62.85 1.46 Allowed Glycine 0 N--CA 1.435 -1.372 0 C-N-CA 120.494 -0.86 . . . . 0.0 111.589 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -106.02 -19.26 13.78 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-O 121.587 0.708 . . . . 0.0 109.246 177.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.08 -13.38 59.73 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.672 175.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.412 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 83.4 m-85 -139.7 132.32 28.84 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 -176.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.57 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.7 mt -80.37 121.82 34.48 Favored 'Isoleucine or valine' 0 C--O 1.252 1.225 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.4 m -101.19 161.73 13.4 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 123.349 0.406 . . . . 0.0 109.978 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.12 -52.89 20.1 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -172.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.33 -29.98 69.68 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 121.73 0.776 . . . . 0.0 109.226 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.18 -39.85 93.44 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.307 -1.315 . . . . 0.0 110.499 175.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.512 HD22 HG12 ' A' ' 121' ' ' VAL . 4.9 tt -64.85 -45.79 84.61 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 177.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.511 ' HG3' HG11 ' A' ' 121' ' ' VAL . 51.0 mtp180 -61.35 -35.67 78.06 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 121.919 -0.488 . . . . 0.0 111.67 175.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -61.37 -51.56 68.29 Favored 'General case' 0 C--O 1.259 1.587 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.818 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.63 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 10.5 p -65.59 -35.41 75.17 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.635 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.911 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.458 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.0 mmt -60.75 -40.18 91.5 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 56.8 m -59.87 -40.9 90.22 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 176.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -72.96 -26.82 61.51 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.491 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 81.8 mt -86.56 -7.45 58.36 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.166 0.507 . . . . 0.0 109.901 -178.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . 0.447 ' HA3' ' HA3' ' A' ' 40' ' ' GLY . . . 70.37 13.6 70.91 Favored Glycine 0 N--CA 1.432 -1.586 0 CA-C-N 115.085 -0.961 . . . . 0.0 113.168 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -86.84 -35.4 19.08 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -178.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp 57.15 94.78 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.307 1.043 . . . . 0.0 111.954 176.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 72.0 mt -110.91 155.86 22.03 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 120.894 0.378 . . . . 0.0 111.292 -176.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.0 p -85.37 161.12 19.6 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.607 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -64.26 -41.14 97.08 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -69.06 -33.36 73.45 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.646 0.736 . . . . 0.0 110.307 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -68.15 -51.59 44.19 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.583 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.512 HG12 HD22 ' A' ' 105' ' ' LEU . 16.7 m -67.79 -30.57 48.9 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.429 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.325 178.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -64.93 -44.01 90.89 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.299 178.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.97 -43.67 98.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 65.4 mtt -56.65 -55.0 39.58 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 124.01 0.819 . . . . 0.0 111.038 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.2 mm -58.11 -55.37 22.52 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.416 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.724 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 -58.14 -43.15 87.17 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 113.186 0.809 . . . . 0.0 113.186 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -76.09 -28.43 57.56 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.396 -176.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -80.12 -28.78 38.92 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.691 0.758 . . . . 0.0 110.076 177.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -76.42 85.45 3.16 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 122.118 0.961 . . . . 0.0 110.664 178.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.0 mt -78.01 -23.29 13.79 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.903 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -83.19 -10.97 58.3 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.907 0.384 . . . . 0.0 111.134 -175.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.34 37.55 70.6 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -94.97 -16.89 22.43 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 121.647 0.737 . . . . 0.0 109.417 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 97.47 -14.75 63.02 Favored Glycine 0 N--CA 1.444 -0.825 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -177.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.412 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 2.1 mp0 -133.98 138.36 45.38 Favored 'General case' 0 CA--C 1.49 -1.361 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 178.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.57 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.7 OUTLIER -80.75 121.46 34.26 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 CA-C-O 121.183 0.516 . . . . 0.0 111.815 -177.904 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.574 ' HB3' ' OE2' ' A' ' 140' ' ' GLU . 50.8 t30 -87.99 166.67 14.32 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.925 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.555 ' O ' HG13 ' A' ' 142' ' ' VAL . 91.1 t80 -61.07 -45.44 94.71 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 123.223 0.609 . . . . 0.0 112.318 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.48 ' O ' HG22 ' A' ' 142' ' ' VAL . 15.1 mm-40 -65.41 -40.86 93.89 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.282 0.563 . . . . 0.0 111.732 -178.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.574 ' OE2' ' HB3' ' A' ' 137' ' ' ASN . 4.8 mp0 -60.54 -43.62 97.0 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.272 175.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -60.09 -47.04 87.55 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.881 176.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.555 HG13 ' O ' ' A' ' 138' ' ' TYR . 4.4 m -63.6 -39.2 84.47 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.491 -178.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -65.49 -42.5 92.1 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.042 -176.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.473 ' HG3' ' N ' ' A' ' 145' ' ' MET . 3.4 ptm -78.62 -37.55 41.94 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 119.937 -0.705 . . . . 0.0 111.726 -178.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.473 ' N ' ' HG3' ' A' ' 144' ' ' MET . 3.0 tmm? -72.87 -38.23 67.08 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.999 -171.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 15.5 m -81.08 -28.03 35.41 Favored 'General case' 0 C--N 1.308 -1.203 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.798 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -95.92 80.65 3.35 Favored 'General case' 0 C--N 1.316 -0.872 0 O-C-N 121.681 -0.637 . . . . 0.0 110.534 178.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.3 mttp . . . . . 0 C--N 1.307 -1.255 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.078 179.898 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.428 -1.555 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -58.46 -46.44 24.35 Favored 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 122.473 2.115 . . . . 0.0 111.562 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -83.81 74.43 10.19 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.99 0.9 . . . . 0.0 110.433 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -153.94 35.69 0.44 Allowed 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -41.17 -71.83 0.07 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.949 1.7 . . . . 0.0 115.207 -172.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -107.97 61.4 0.61 Allowed 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 176.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 60.34 26.71 16.24 Favored 'General case' 0 C--O 1.208 -1.097 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.861 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -42.91 -52.29 5.2 Favored 'General case' 0 C--O 1.21 -1.005 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -77.6 -27.1 51.19 Favored 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 119.522 -0.871 . . . . 0.0 112.341 -175.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -73.54 -43.06 60.84 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 176.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -73.68 -34.86 65.07 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.857 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -73.43 -36.11 65.89 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -58.57 -53.88 53.39 Favored 'General case' 0 CA--C 1.493 -1.214 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 174.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -57.52 -40.19 78.18 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 114.553 -1.203 . . . . 0.0 112.756 176.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.85 -54.72 38.29 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 122.46 0.304 . . . . 0.0 111.382 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.573 ' O ' ' HB3' ' B' ' 93' ' ' LYS . 44.3 pt -64.33 -35.82 75.29 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.845 0 CA-C-O 120.941 0.4 . . . . 0.0 110.611 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . 0.604 ' O ' ' HB3' ' B' ' 94' ' ' HIS . 7.9 tt0 -69.59 -41.16 76.15 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.421 179.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' B' ' 95' ' ' MET . 23.4 tptm -65.34 -45.49 84.02 Favored 'General case' 0 C--O 1.205 -1.248 0 C-N-CA 122.701 0.401 . . . . 0.0 110.508 -177.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.6 -47.55 11.97 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -175.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.573 ' HB3' ' O ' ' B' ' 89' ' ' ILE . 0.3 OUTLIER -74.5 -5.53 43.17 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-O 121.529 0.68 . . . . 0.0 112.083 -177.435 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.604 ' HB3' ' O ' ' B' ' 90' ' ' GLN . 26.8 t60 -137.38 24.24 2.95 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.819 0.819 . . . . 0.0 109.522 -178.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.47 ' HB2' ' O ' ' B' ' 91' ' ' LYS . 53.2 ttp -68.36 -53.08 18.96 Favored Pre-proline 0 CA--C 1.552 1.036 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.46 27.23 0.59 Allowed 'Trans proline' 0 C--N 1.368 1.569 0 C-N-CA 121.902 1.735 . . . . 0.0 113.022 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -125.61 168.09 14.78 Favored Pre-proline 0 C--N 1.305 -1.345 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 177.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_exo -60.11 110.1 0.72 Allowed 'Trans proline' 0 C--O 1.244 0.803 0 N-CA-C 107.558 -1.747 . . . . 0.0 107.558 168.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . 0.418 ' HE1' ' HG2' ' B' ' 90' ' ' GLN . 14.2 t90 -76.64 84.92 3.3 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -170.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.287 -2.152 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 174.813 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.493 ' HB3' ' HA ' ' A' ' 74' ' ' ARG . . . . . . . . 0 C--O 1.217 -0.635 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -133.34 24.82 4.15 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.514 ' OE1' ' HG2' ' A' ' 77' ' ' LYS . 88.9 mt-30 -74.5 85.43 2.03 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.535 0.683 . . . . 0.0 112.741 -175.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.433 HD12 ' HE1' ' A' ' 76' ' ' MET . 1.2 tp -133.11 111.41 10.91 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 45.5 p -80.73 156.2 26.36 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.869 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -57.22 -33.33 67.43 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 123.45 0.7 . . . . 0.0 112.345 -174.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.512 ' CD ' ' H ' ' A' ' 7' ' ' GLU . 2.0 mp0 -61.01 -46.2 91.73 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.022 0.915 . . . . 0.0 109.293 178.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.463 ' O ' ' HB3' ' A' ' 11' ' ' GLU . 62.0 tt0 -75.08 -33.17 61.62 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 114.623 -1.172 . . . . 0.0 110.14 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.628 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 67.3 mt -63.98 -37.32 79.5 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.57 -40.89 88.83 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 122.631 0.372 . . . . 0.0 110.725 175.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.463 ' HB3' ' O ' ' A' ' 8' ' ' GLN . 10.3 tp10 -57.13 -50.75 71.84 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 174.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -62.68 -30.27 71.27 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.936 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.628 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 91.1 mttt -62.14 -48.26 80.89 Favored 'General case' 0 C--O 1.252 1.224 0 CA-C-O 121.243 0.544 . . . . 0.0 110.477 179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -71.98 -43.73 64.66 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.103 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.56 -48.58 74.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.927 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.54 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 56.7 t80 -58.15 -55.34 36.28 Favored 'General case' 0 C--O 1.189 -2.098 0 C-N-CA 124.082 0.953 . . . . 0.0 110.425 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.9 m -68.72 -17.02 63.99 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 123.402 0.438 . . . . 0.0 111.677 -174.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.87 -43.25 84.05 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 174.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.639 ' HB2' HG11 ' A' ' 35' ' ' VAL . 35.2 p90 -96.6 -24.06 16.21 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 119.713 -0.795 . . . . 0.0 111.945 -178.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -79.18 81.55 5.43 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 168.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -58.45 -31.43 67.77 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.466 -1.697 . . . . 0.0 114.241 -169.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.435 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 34.3 m-20 -88.05 -13.0 42.66 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.311 -0.956 . . . . 0.0 111.845 178.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.94 61.09 6.77 Favored Glycine 0 CA--C 1.518 0.233 0 O-C-N 123.285 0.365 . . . . 0.0 112.318 -179.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.435 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 5.3 m-20 -111.09 -16.8 13.39 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.108 0.48 . . . . 0.0 109.889 -175.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.8 13.87 64.02 Favored Glycine 0 C--O 1.215 -1.087 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -174.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.598 ' HA ' ' O ' ' A' ' 63' ' ' ILE . 17.2 p -143.41 138.42 29.34 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 122.989 0.516 . . . . 0.0 109.973 177.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mt -104.81 127.7 59.08 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 177.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.7 p -98.86 171.55 8.0 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 28.1 p -58.93 -39.41 81.49 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-O 120.984 0.421 . . . . 0.0 110.502 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -50.66 -55.1 17.98 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.014 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -66.82 -44.29 81.53 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.755 -174.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 75.6 mt -53.6 -51.68 62.26 Favored 'General case' 0 CA--C 1.51 -0.579 0 O-C-N 123.851 0.719 . . . . 0.0 111.105 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.534 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -72.9 -37.02 57.09 Favored Glycine 0 C--O 1.192 -2.471 0 C-N-CA 119.25 -1.452 . . . . 0.0 112.832 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.2 m -58.73 -48.36 81.44 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-N 118.593 1.196 . . . . 0.0 110.716 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.639 HG11 ' HB2' ' A' ' 19' ' ' PHE . 17.0 m -67.59 -34.71 69.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.31 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.3 mtm -73.37 -37.0 66.18 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 31.2 mtm180 -66.43 -30.31 70.64 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.7 m -71.74 -30.68 65.88 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.496 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.7 mt -84.07 -15.18 48.36 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.816 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.5 37.1 1.97 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.697 -0.764 . . . . 0.0 114.633 175.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -148.42 131.17 16.0 Favored 'General case' 0 CA--C 1.503 -0.858 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 173.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -114.98 80.36 6.74 Favored Pre-proline 0 C--N 1.31 -1.133 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.639 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -76.12 154.44 37.33 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.154 1.903 . . . . 0.0 110.688 175.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.6 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 51.8 p -83.31 164.05 20.29 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -178.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -66.56 -27.1 67.47 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 -177.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.24 -45.13 91.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.313 0.577 . . . . 0.0 109.685 175.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' A' ' 51' ' ' MET . 34.5 mt-10 -67.49 -48.3 67.51 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.621 178.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 44' ' ' THR . 73.9 mt -57.27 -41.32 79.46 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.162 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 -70.42 -35.59 73.51 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.02 -178.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.47 -41.01 85.3 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.629 ' HB3' ' SD ' ' B' ' 95' ' ' MET . 66.4 mtt -54.89 -46.07 74.77 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.194 176.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 67.6 mt -67.19 -55.11 18.82 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.778 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.311 178.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.448 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.6 t30 -55.72 -32.64 63.52 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -171.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -61.73 -36.75 81.88 Favored 'General case' 0 N--CA 1.385 -3.707 0 C-N-CA 123.408 0.683 . . . . 0.0 112.587 178.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.538 HG11 ' HB2' ' A' ' 71' ' ' MET . 34.5 m -98.43 -13.95 7.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-O 120.909 0.385 . . . . 0.0 110.149 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.448 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 33.2 t0 -79.21 105.61 10.66 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.89 -177.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.49 -9.31 56.48 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.964 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.17 -11.8 31.88 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.197 -176.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.99 37.59 91.68 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.799 -176.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -115.17 -14.96 11.71 Favored 'General case' 0 C--N 1.32 -0.712 0 O-C-N 122.673 -0.31 . . . . 0.0 111.248 -176.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.23 23.16 32.78 Favored Glycine 0 N--CA 1.433 -1.517 0 C-N-CA 120.438 -0.886 . . . . 0.0 113.385 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.7 p -133.57 136.74 45.12 Favored 'General case' 0 C--O 1.252 1.203 0 CA-C-N 117.37 0.585 . . . . 0.0 111.379 178.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.598 ' O ' ' HA ' ' A' ' 26' ' ' THR . 51.2 mt -91.69 110.74 23.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.121 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -75.35 154.9 37.01 Favored 'General case' 0 C--N 1.279 -2.461 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.462 ' CZ ' ' HG2' ' A' ' 13' ' ' LYS . 63.1 t80 -51.41 -51.62 67.27 Favored Pre-proline 0 C--N 1.311 -1.093 0 O-C-N 123.422 0.451 . . . . 0.0 111.668 176.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -49.98 -40.74 49.52 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.707 2.272 . . . . 0.0 112.397 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -69.6 -40.64 76.54 Favored 'General case' 0 C--O 1.22 -0.449 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.54 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 38.4 t80 -58.55 -40.49 83.17 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.205 0.602 . . . . 0.0 109.563 174.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 94.1 mt -64.94 -51.6 60.93 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.747 176.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 74.3 m -57.04 -45.87 82.84 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.826 0.45 . . . . 0.0 111.018 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.538 ' HB2' HG11 ' A' ' 55' ' ' VAL . 26.9 ttp -58.68 -44.09 90.15 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.49 0.716 . . . . 0.0 111.642 178.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.5 tpp -74.61 -36.3 62.95 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.153 -177.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.22 -48.57 80.86 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.269 177.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.493 ' HA ' ' HB3' ' A' ' 1' ' ' ALA . 82.9 mtp180 -70.12 -16.44 63.11 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.409 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.41 ' HD3' ' OE1' ' B' ' 90' ' ' GLN . 39.3 ttmt -88.82 -16.25 32.52 Favored 'General case' 0 C--N 1.297 -1.716 0 C-N-CA 123.032 0.533 . . . . 0.0 111.632 178.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.433 ' HE1' HD12 ' A' ' 4' ' ' LEU . 48.9 ttp -116.48 -64.36 1.32 Allowed 'General case' 0 C--O 1.244 0.812 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 -167.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.514 ' HG2' ' OE1' ' A' ' 3' ' ' GLN . 84.0 tttt -127.07 132.42 50.67 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -166.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 25.5 t70 80.7 10.47 1.04 Allowed 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 127.105 2.162 . . . . 0.0 106.231 -169.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 90.3 m -102.08 143.17 32.25 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 111.901 -2.409 . . . . 0.0 110.319 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.628 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 43.6 m-20 80.71 82.7 0.04 OUTLIER 'General case' 0 CA--C 1.496 -1.122 0 C-N-CA 124.646 1.178 . . . . 0.0 113.231 172.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.9 p -113.11 -60.96 1.81 Allowed 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -141.51 -58.09 0.48 Allowed 'General case' 0 N--CA 1.418 -2.031 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.134 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -68.85 -38.46 79.81 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.76 -173.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.628 ' HB2' ' HA ' ' A' ' 80' ' ' ASP . 42.8 mm-40 -56.76 -38.21 72.14 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.214 0.53 . . . . 0.0 110.058 175.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.489 HG21 HG12 ' A' ' 142' ' ' VAL . 15.0 mm -68.2 -46.83 80.48 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.693 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -178.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.5 ttm180 -71.02 -29.73 65.74 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 114.314 -1.312 . . . . 0.0 112.588 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -68.06 -44.47 76.27 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.504 0.669 . . . . 0.0 109.625 174.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.471 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -68.52 -24.29 64.63 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.741 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -81.46 -42.01 20.95 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 121.121 0.486 . . . . 0.0 109.903 176.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.1 tpp180 -57.39 -33.23 67.62 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.072 1.349 . . . . 0.0 112.612 -177.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.487 HG22 HG21 ' A' ' 108' ' ' VAL . 11.6 p -58.42 -31.08 42.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.255 178.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.507 ' HB3' HG23 ' A' ' 100' ' ' ILE . 61.2 m-85 -93.86 -60.93 1.64 Allowed 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -85.79 87.19 7.37 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 122.313 1.054 . . . . 0.0 110.149 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -78.51 -39.89 36.77 Favored 'General case' 0 C--N 1.288 -2.077 0 CA-C-N 113.399 -1.728 . . . . 0.0 111.259 -175.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -79.79 -13.15 59.63 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.919 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.87 50.88 5.35 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.309 -0.948 . . . . 0.0 110.921 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -97.9 -12.63 21.86 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-O 121.268 0.556 . . . . 0.0 109.835 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.403 ' O ' ' HA ' ' A' ' 137' ' ' ASN . . . 78.79 20.42 70.95 Favored Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.935 176.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.417 ' HA ' ' O ' ' A' ' 136' ' ' VAL . 21.8 p90 -150.52 154.89 38.43 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 117.037 0.418 . . . . 0.0 110.669 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.552 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.2 mt -110.65 137.62 42.27 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 177.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 14.8 m -116.69 154.72 30.09 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 123.973 0.796 . . . . 0.0 109.507 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.71 -44.15 82.43 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -175.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.68 -49.16 76.23 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 120.643 0.258 . . . . 0.0 110.945 -178.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -55.42 -46.62 76.65 Favored 'General case' 0 CA--C 1.501 -0.928 0 C-N-CA 123.164 0.586 . . . . 0.0 110.33 176.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.417 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.4 tt -59.16 -44.65 92.14 Favored 'General case' 0 N--CA 1.424 -1.73 0 CA-C-N 115.087 -0.96 . . . . 0.0 108.899 -173.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.666 ' HG3' HG21 ' A' ' 121' ' ' VAL . 33.0 mtp180 -62.29 -37.19 84.58 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 120.977 0.418 . . . . 0.0 111.805 174.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -60.96 -44.94 96.59 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.663 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.487 HG21 HG22 ' A' ' 91' ' ' VAL . 8.9 p -72.84 -31.39 36.09 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.213 0 C-N-CA 119.71 -0.796 . . . . 0.0 110.375 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.511 ' HG3' HD12 ' A' ' 116' ' ' LEU . 21.8 mmt -64.22 -44.73 90.98 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-O 120.57 0.224 . . . . 0.0 111.433 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 22.2 m -61.41 -33.55 73.88 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.245 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -75.21 -31.58 60.94 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.918 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.9 mt -81.88 -18.36 44.06 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.647 0.737 . . . . 0.0 109.904 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 86.09 21.93 50.62 Favored Glycine 0 N--CA 1.433 -1.552 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.54 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -101.6 122.28 43.56 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -83.16 107.88 16.03 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 123.475 0.484 . . . . 0.0 110.135 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.511 HD12 ' HG3' ' A' ' 109' ' ' MET . 20.8 mt -124.97 152.13 44.57 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 176.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 50.9 p -87.06 174.5 8.62 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -71.65 -30.09 65.35 Favored 'General case' 0 C--O 1.207 -1.134 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 175.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.9 -49.45 77.41 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 114.834 -1.075 . . . . 0.0 109.559 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -56.86 -55.22 37.22 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.166 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.666 HG21 ' HG3' ' A' ' 106' ' ' ARG . 11.3 m -68.5 -32.0 53.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.372 -175.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -67.42 -44.9 77.65 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -63.87 -39.7 94.81 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 123.472 0.483 . . . . 0.0 110.337 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.3 mtt -52.6 -54.16 36.81 Favored 'General case' 0 CA--C 1.499 -0.989 0 O-C-N 124.133 0.896 . . . . 0.0 110.452 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mm -65.39 -55.73 18.75 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.192 0 O-C-N 123.777 0.673 . . . . 0.0 110.448 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 50.7 ttt180 -49.06 -47.07 45.25 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 125.145 1.378 . . . . 0.0 113.989 -173.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.525 ' HB3' ' CZ ' ' B' ' 81' ' ' PHE . 7.9 tp10 -82.8 -27.2 31.11 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.665 -177.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.86 -19.96 47.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 122.309 1.052 . . . . 0.0 109.454 179.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 134' ' ' GLY . 9.5 t70 -73.23 74.51 1.3 Allowed 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.643 176.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.1 mt -75.89 -14.65 15.22 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 CA-C-N 114.342 -1.299 . . . . 0.0 107.922 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -81.66 -10.29 59.44 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.695 -1.139 . . . . 0.0 109.788 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 59.97 31.34 72.15 Favored Glycine 0 C--N 1.34 0.773 0 CA-C-N 115.013 -0.994 . . . . 0.0 113.757 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -115.42 -11.72 11.81 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 121.531 0.681 . . . . 0.0 111.15 -173.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.424 ' H ' ' CG ' ' A' ' 129' ' ' ASP . . . 94.81 14.78 48.34 Favored Glycine 0 C--N 1.304 -1.201 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -177.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -143.71 124.51 14.22 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.552 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.9 OUTLIER -88.79 112.86 24.62 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.88 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.988 179.203 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.403 ' HA ' ' O ' ' A' ' 98' ' ' GLY . 48.4 m-80 -81.84 160.99 23.37 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.939 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.441 ' O ' HG13 ' A' ' 142' ' ' VAL . 71.7 t80 -57.24 -42.36 81.3 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.692 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -62.22 -21.58 65.25 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -87.87 -44.91 10.72 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -62.97 -38.45 91.16 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.376 -1.284 . . . . 0.0 112.609 -177.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.489 HG12 HG21 ' A' ' 85' ' ' ILE . 25.5 m -57.14 -30.43 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-O 121.18 0.515 . . . . 0.0 111.982 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -79.28 -26.38 42.35 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 121.495 0.664 . . . . 0.0 111.178 -177.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 85.5 mtp -80.06 -19.13 48.26 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.898 -175.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.438 ' HG2' ' CD1' ' A' ' 85' ' ' ILE . 58.4 tpp -62.98 -22.71 67.02 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -176.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 14.0 t -81.0 -2.97 50.08 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.196 -177.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -93.51 19.73 8.11 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 121.757 0.789 . . . . 0.0 110.119 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt . . . . . 0 C--N 1.302 -1.491 0 CA-C-N 113.579 -1.646 . . . . 0.0 112.838 -178.112 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.439 -1.02 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.54 -29.11 77.34 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 122.94 2.427 . . . . 0.0 112.813 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.08 22.0 2.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.882 -178.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 38.6 p30 -66.37 -18.74 65.54 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 19.1 m -90.36 15.84 9.85 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-O 121.099 0.476 . . . . 0.0 109.932 176.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 49.59 -87.98 0.01 OUTLIER 'General case' 0 C--O 1.246 0.907 0 C-N-CA 126.413 1.885 . . . . 0.0 115.132 174.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -65.65 -24.47 67.03 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 122.584 0.354 . . . . 0.0 111.455 -175.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . 0.525 ' CZ ' ' HB3' ' A' ' 127' ' ' GLU . 72.8 t80 -53.02 -38.72 62.59 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.66 0.784 . . . . 0.0 111.304 176.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . 0.504 ' HE3' ' OE1' ' B' ' 83' ' ' GLU . 2.9 tmmm? -71.61 -49.99 35.09 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . 0.504 ' OE1' ' HE3' ' B' ' 82' ' ' LYS . 11.9 mm-40 -65.9 -26.85 67.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.521 0.201 . . . . 0.0 111.326 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.72 -56.07 26.46 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 172.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.491 ' O ' HG12 ' B' ' 89' ' ' ILE . 60.4 m95 -61.51 -42.55 98.98 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.186 176.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . 0.403 ' HG2' ' OE1' ' B' ' 83' ' ' GLU . 19.0 tptm -49.0 -55.18 12.72 Favored 'General case' 0 CA--C 1.501 -0.904 0 C-N-CA 125.424 1.49 . . . . 0.0 110.057 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -63.42 -46.43 86.39 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.305 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.16 -52.52 65.35 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 123.538 0.524 . . . . 0.0 112.387 -177.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.491 HG12 ' O ' ' B' ' 85' ' ' TRP . 29.3 pt -68.92 -29.18 42.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.129 0.49 . . . . 0.0 111.225 -177.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . 0.485 ' OE1' ' HA ' ' B' ' 96' ' ' PRO . 8.2 tt0 -78.25 -42.77 30.1 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.652 -179.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 12.0 tppt? -55.28 -37.65 67.58 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.063 1.345 . . . . 0.0 109.235 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.428 ' HB2' HG11 ' A' ' 91' ' ' VAL . . . -63.43 -31.49 72.66 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.54 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -86.55 -53.88 4.72 Favored 'General case' 0 N--CA 1.433 -1.308 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -161.04 179.75 8.18 Favored 'General case' 0 C--O 1.208 -1.094 0 C-N-CA 124.349 1.06 . . . . 0.0 108.484 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.629 ' SD ' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -64.62 122.01 76.26 Favored Pre-proline 0 C--N 1.291 -1.937 0 CA-C-O 121.242 0.544 . . . . 0.0 111.91 179.705 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.485 ' HA ' ' OE1' ' B' ' 90' ' ' GLN . 60.5 Cg_endo -93.45 -4.9 2.92 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 124.138 3.225 . . . . 0.0 113.315 -177.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . 0.563 ' HB2' ' HD3' ' B' ' 98' ' ' PRO . 5.8 m-20 -86.44 -48.57 0.52 Allowed Pre-proline 0 C--N 1.288 -2.099 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.774 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . 0.563 ' HD3' ' HB2' ' B' ' 97' ' ' ASP . 17.2 Cg_exo -77.77 52.37 3.95 Favored 'Trans proline' 0 C--N 1.371 1.715 0 C-N-CA 122.439 2.093 . . . . 0.0 110.18 169.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 68.1 t90 -87.67 -34.31 18.48 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.41 -2.451 0 N-CA-C 105.485 -2.042 . . . . 0.0 105.485 -176.487 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.497 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -129.4 -4.42 4.84 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.9 0.857 . . . . 0.0 108.838 171.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -113.63 123.56 50.23 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.454 ' HB3' HD11 ' A' ' 9' ' ' ILE . 11.4 tp -96.42 159.77 14.76 Favored 'General case' 0 C--N 1.291 -1.956 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.52 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.48 ' O ' HG13 ' A' ' 9' ' ' ILE . 34.5 p -86.76 143.52 27.48 Favored 'General case' 0 N--CA 1.42 -1.929 0 C-N-CA 123.214 0.606 . . . . 0.0 110.811 -177.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -52.19 -46.76 65.68 Favored 'General case' 0 C--O 1.244 0.786 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -174.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -60.32 -46.32 90.29 Favored 'General case' 0 CA--C 1.512 -0.488 0 O-C-N 123.269 0.356 . . . . 0.0 110.548 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.408 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 23.0 tp60 -66.13 -37.84 86.7 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.659 -178.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.503 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 30.5 mt -63.5 -43.01 98.17 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.0 177.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.79 -41.83 91.47 Favored 'General case' 0 C--O 1.259 1.584 0 CA-C-O 121.399 0.618 . . . . 0.0 110.935 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -60.68 -43.82 97.25 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.126 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.416 ' CZ ' ' HG3' ' A' ' 72' ' ' MET . 19.4 m-85 -62.92 -40.83 98.8 Favored 'General case' 0 C--O 1.168 -3.234 0 CA-C-O 118.609 -0.71 . . . . 0.0 111.984 175.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.8 mttt -47.99 -52.54 19.41 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 121.388 0.613 . . . . 0.0 111.987 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -66.75 -48.14 70.02 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.0 -177.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.05 -31.53 69.19 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.434 0.635 . . . . 0.0 111.902 -177.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -65.41 -40.3 93.21 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 124.591 1.156 . . . . 0.0 109.702 177.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 26.1 m -69.87 -25.51 63.75 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.066 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -70.89 -43.19 68.86 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.402 ' CZ ' ' HA ' ' B' ' 100' ' ' ALA . 3.6 m-85 -66.04 -43.05 88.65 Favored 'General case' 0 CA--C 1.5 -0.975 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.339 178.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -69.76 101.27 1.66 Allowed 'General case' 0 C--N 1.313 -1.017 0 O-C-N 123.947 0.779 . . . . 0.0 109.848 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -77.19 1.92 16.98 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -109.44 -13.78 14.53 Favored 'General case' 0 CA--C 1.51 -0.574 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 175.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.39 24.54 73.67 Favored Glycine 0 N--CA 1.437 -1.234 0 CA-C-N 114.608 -1.178 . . . . 0.0 112.164 -176.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -98.95 -18.54 17.78 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 119.572 -0.851 . . . . 0.0 112.205 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.25 29.73 7.77 Favored Glycine 0 C--N 1.307 -1.033 0 C-N-CA 120.677 -0.773 . . . . 0.0 114.603 175.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.8 p -145.43 129.86 17.81 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 173.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 51.6 mt -101.7 115.45 43.51 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 C-N-CA 120.29 -0.564 . . . . 0.0 109.987 -177.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.9 p -84.66 178.01 7.83 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.522 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.7 p -64.83 -29.25 70.2 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.475 0.655 . . . . 0.0 109.55 176.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.9 tttp -59.23 -57.85 11.2 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.772 177.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -64.48 -39.4 93.73 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 114.265 -1.334 . . . . 0.0 111.093 -177.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.423 ' HB3' ' HE3' ' A' ' 36' ' ' MET . 56.5 mt -56.17 -57.5 11.91 Favored 'General case' 0 CA--C 1.511 -0.532 0 O-C-N 123.373 0.421 . . . . 0.0 110.548 175.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.72 -31.31 79.66 Favored Glycine 0 C--O 1.211 -1.285 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.366 -178.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.9 m -69.13 -46.99 66.26 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 116.839 0.32 . . . . 0.0 110.825 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 28.4 m -70.69 -28.64 34.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 121.306 0.575 . . . . 0.0 110.755 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.532 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 22.2 mtt -68.81 -40.81 79.35 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 173.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -66.35 -30.57 71.0 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 123.851 0.86 . . . . 0.0 110.891 178.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.7 m -64.53 -25.95 68.21 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.462 0.649 . . . . 0.0 110.132 176.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -106.34 13.92 28.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.023 178.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.1 34.65 41.01 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 115.386 0.914 . . . . 0.0 115.386 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.459 ' C ' HD22 ' A' ' 42' ' ' ASN . 4.8 tt0 -131.22 129.84 42.15 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 118.295 1.047 . . . . 0.0 109.853 176.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.459 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.82 86.02 45.36 Favored Pre-proline 0 C--N 1.305 -1.347 0 O-C-N 122.126 -0.359 . . . . 0.0 110.489 176.75 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.532 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 16.6 Cg_exo -70.02 163.62 37.82 Favored 'Trans proline' 0 C--O 1.246 0.905 0 C-N-CA 122.992 2.461 . . . . 0.0 111.96 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.505 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 44.0 p -73.85 142.96 46.06 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 174.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -72.13 -19.08 61.84 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.034 -174.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.83 -39.72 92.8 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.095 174.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.505 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 37.8 mm-40 -65.14 -42.54 93.71 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 69.9 mt -65.89 -40.55 91.65 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.82 -1.082 . . . . 0.0 112.983 -175.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.29 -44.96 93.56 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.82 177.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -64.16 -38.04 89.61 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.984 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 38.4 tpp -60.11 -50.89 71.91 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.977 -1.011 . . . . 0.0 109.798 178.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.8 mt -60.79 -51.79 69.1 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.483 177.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.407 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 12.2 t30 -63.92 -13.4 45.29 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -173.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -72.28 -40.99 67.2 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.599 HG11 ' HB2' ' A' ' 71' ' ' MET . 22.0 m -97.24 -21.98 5.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.211 -176.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 34.9 t0 -72.36 112.08 8.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.299 -179.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.51 -27.12 24.2 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-O 121.194 0.521 . . . . 0.0 110.914 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.33 -11.81 31.5 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -174.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 60.52 58.68 12.67 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.414 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -102.88 -16.83 15.77 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.2 23.35 34.91 Favored Glycine 0 N--CA 1.419 -2.451 0 N-CA-C 108.83 -1.708 . . . . 0.0 108.83 -173.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 49.4 p -140.35 137.13 33.84 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-N 115.567 -0.316 . . . . 0.0 111.039 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 57.5 mt -91.03 104.77 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.538 0 N-CA-C 104.269 -2.493 . . . . 0.0 104.269 173.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -84.0 168.17 16.2 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.553 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 57.8 t80 -52.87 -56.01 27.61 Favored Pre-proline 0 CA--C 1.554 1.128 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -175.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.75 -39.79 75.95 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 122.621 2.214 . . . . 0.0 112.547 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -70.38 -37.6 74.57 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.309 0.576 . . . . 0.0 110.056 -177.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -62.76 -41.97 99.47 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 72.2 mt -62.24 -49.28 76.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.014 178.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.1 m -56.87 -42.8 80.44 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.356 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.599 ' HB2' HG11 ' A' ' 55' ' ' VAL . 32.1 ttp -58.76 -46.68 86.9 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.165 0.586 . . . . 0.0 111.689 178.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.416 ' HG3' ' CZ ' ' A' ' 12' ' ' PHE . 23.2 mmt -71.76 -37.39 70.5 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.716 -177.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.31 -43.19 99.4 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -63.39 -28.94 70.33 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.69 176.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.435 ' HZ1' ' CG ' ' B' ' 97' ' ' ASP . 40.2 ttmt -69.01 -38.3 79.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 62.9 mtt -69.42 -47.96 62.5 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.51 179.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 87.3 tttt 68.44 -28.04 0.15 Allowed 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 174.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 82.09 12.69 0.59 Allowed 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 126.264 1.826 . . . . 0.0 109.219 -172.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.9 m -139.17 37.59 2.11 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -80.77 -36.22 32.15 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.202 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.7 m -69.47 125.51 26.93 Favored 'General case' 0 N--CA 1.427 -1.599 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.46 -172.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 70.76 -48.65 0.66 Allowed 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 125.564 1.546 . . . . 0.0 112.949 -177.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -66.33 -50.11 64.71 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 120.839 0.352 . . . . 0.0 111.668 -172.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -84.68 -26.0 28.04 Favored 'General case' 0 CA--C 1.494 -1.186 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.991 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.404 HD12 ' HG2' ' A' ' 145' ' ' MET . 4.9 mm -72.79 -36.69 53.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.733 -175.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -73.13 -30.94 63.97 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 176.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -67.99 -46.18 72.01 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.93 -27.91 69.17 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.024 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -76.55 -46.3 26.96 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -57.48 -38.7 74.97 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.529 1.132 . . . . 0.0 111.43 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.594 ' O ' ' HE2' ' A' ' 94' ' ' LYS . 11.6 p -68.06 -19.85 25.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.754 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -96.19 -52.39 4.03 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.742 177.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -80.46 100.94 8.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.576 0.703 . . . . 0.0 111.073 -178.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.594 ' HE2' ' O ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -78.52 -24.04 45.97 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.487 -0.779 . . . . 0.0 113.081 -179.424 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.91 -13.89 52.37 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.556 -0.858 . . . . 0.0 110.523 -176.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.28 43.26 95.49 Favored Glycine 0 CA--C 1.499 -0.924 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 178.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -101.61 -19.27 15.52 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 120.951 0.405 . . . . 0.0 110.603 -174.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.96 11.52 60.1 Favored Glycine 0 C--N 1.314 -0.684 0 C-N-CA 119.517 -1.325 . . . . 0.0 111.366 -179.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.554 ' HB3' HE21 ' A' ' 135' ' ' GLN . 51.9 m-85 -140.93 130.74 24.31 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.426 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.0 mt -103.59 133.74 46.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.8 t -100.95 158.94 15.62 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.88 -42.56 76.83 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 177.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.18 -33.52 75.65 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.772 177.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.511 ' O ' ' HB3' ' A' ' 107' ' ' HIS . 4.2 tp10 -65.52 -49.44 68.98 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 174.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.552 ' O ' ' HG2' ' A' ' 109' ' ' MET . 22.0 mt -56.52 -48.23 77.66 Favored 'General case' 0 N--CA 1.418 -2.072 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.4 -176.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.403 ' HB2' HG21 ' A' ' 121' ' ' VAL . 2.1 tmm_? -56.1 -43.96 78.57 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.511 ' HB3' ' O ' ' A' ' 104' ' ' GLU . 6.8 t-80 -52.87 -55.71 21.15 Favored 'General case' 0 C--O 1.254 1.316 0 C-N-CA 123.996 0.918 . . . . 0.0 111.365 176.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.461 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.6 p -73.24 -33.51 41.64 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.641 0 C-N-CA 120.243 -0.583 . . . . 0.0 111.494 -176.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.552 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.2 mmt -64.87 -43.71 92.05 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 122.432 0.293 . . . . 0.0 111.279 -178.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 40.6 m -62.04 -35.5 78.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -73.04 -27.21 61.62 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.113 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 78.0 mt -89.14 -21.18 23.47 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.03 -0.419 . . . . 0.0 111.73 -177.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 101.51 20.27 13.81 Favored Glycine 0 C--N 1.312 -0.794 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.21 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.495 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 1.4 mp0 -100.32 110.68 22.91 Favored 'General case' 0 C--N 1.309 -1.156 0 C-N-CA 123.476 0.71 . . . . 0.0 109.779 178.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -82.03 69.63 8.78 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 122.236 1.017 . . . . 0.0 111.591 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.607 HD13 ' SD ' ' A' ' 124' ' ' MET . 56.6 mt -101.85 139.32 37.65 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 177.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 40.2 p -84.58 171.33 12.55 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.38 -31.89 73.17 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -66.15 -51.21 60.05 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.813 177.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.556 ' O ' ' HG3' ' A' ' 124' ' ' MET . 29.0 tt0 -66.56 -42.87 86.41 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.877 -176.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.53 ' HA ' ' SD ' ' A' ' 124' ' ' MET . 23.1 m -66.12 -31.36 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 120.429 -0.509 . . . . 0.0 111.169 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -68.06 -38.86 82.92 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.484 0.659 . . . . 0.0 109.702 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -66.38 -32.41 73.77 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.335 175.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.607 ' SD ' HD13 ' A' ' 116' ' ' LEU . 92.6 mtp -63.58 -45.01 92.38 Favored 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 174.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.3 mm -57.58 -50.25 77.89 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.144 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.246 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 126' ' ' ARG . 15.2 ttp180 -59.28 -25.01 63.73 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 124' ' ' MET . 30.2 mm-40 -65.83 -48.88 70.16 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.974 0.416 . . . . 0.0 111.448 173.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -91.81 -23.45 19.7 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -173.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.498 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 30.2 t70 -72.8 96.28 2.04 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 176.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.0 mt -83.53 -53.08 12.1 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.559 -176.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -79.6 -9.66 59.66 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -173.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.498 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 81.37 55.91 3.12 Favored Glycine 0 C--N 1.307 -1.041 0 C-N-CA 120.746 -0.74 . . . . 0.0 113.482 173.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -104.37 -16.18 15.2 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 98.0 -5.01 61.25 Favored Glycine 0 CA--C 1.494 -1.247 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.554 HE21 ' HB3' ' A' ' 99' ' ' TYR . 28.9 mt-30 -143.59 127.08 16.88 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.426 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.7 OUTLIER -76.05 128.43 37.45 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 123.795 0.684 . . . . 0.0 112.769 -176.141 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.2 m-80 -83.83 162.28 20.63 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.429 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -64.89 -39.06 92.94 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.73 -21.7 63.44 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.552 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -88.18 -39.92 14.12 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -62.88 -42.83 99.91 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.835 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 27.6 m -62.07 -30.83 49.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-O 121.077 0.465 . . . . 0.0 111.132 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -48.88 31.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 25.7 ttt -60.54 -42.18 95.99 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.996 0.427 . . . . 0.0 110.765 178.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.404 ' HG2' HD12 ' A' ' 85' ' ' ILE . 41.2 tpp -60.54 -27.26 67.52 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.742 0.817 . . . . 0.0 112.362 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 12.4 p -104.38 2.63 31.47 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.035 0.445 . . . . 0.0 111.404 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -92.55 91.28 7.51 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 121.262 0.553 . . . . 0.0 111.552 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 51.6 mtpt . . . . . 0 C--N 1.31 -1.134 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 176.005 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 45.9 t . . . . . 0 N--CA 1.438 -1.037 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -80.23 -13.47 12.47 Favored 'Trans proline' 0 N--CA 1.447 -1.234 0 C-N-CA 121.824 1.683 . . . . 0.0 111.122 175.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . 67.48 -52.76 0.49 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.824 1.65 . . . . 0.0 113.006 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -134.57 116.87 15.53 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 15.1 m -105.82 22.26 15.89 Favored 'General case' 0 C--N 1.291 -1.96 0 CA-C-O 120.999 0.428 . . . . 0.0 110.375 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -126.23 78.02 1.73 Allowed 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 112.179 0.436 . . . . 0.0 112.179 -172.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . 0.423 ' HA ' ' HB2' ' B' ' 83' ' ' GLU . 33.8 m80 63.85 -34.9 0.15 Allowed 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 174.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -67.65 -57.33 6.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 118.866 0.757 . . . . 0.0 111.378 -176.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -67.76 -32.94 73.87 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.657 0.741 . . . . 0.0 109.165 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . 0.423 ' HB2' ' HA ' ' B' ' 80' ' ' HIS . 38.8 mt-10 -69.28 -26.26 64.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.689 -176.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.13 95.5 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.571 ' O ' HG12 ' B' ' 89' ' ' ILE . 86.0 m95 -65.75 -48.56 71.44 Favored 'General case' 0 CA--C 1.496 -1.097 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.063 176.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -55.93 -45.14 78.85 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 124.003 0.814 . . . . 0.0 110.771 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 27.0 m80 -61.72 -56.93 14.38 Favored 'General case' 0 C--O 1.206 -1.204 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.033 176.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.43 -51.85 63.64 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.635 ' O ' ' HE3' ' B' ' 93' ' ' LYS . 37.8 pt -62.57 -43.3 98.32 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.164 -177.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . 0.413 ' HG3' HG13 ' B' ' 89' ' ' ILE . 27.6 mt-30 -71.78 -42.98 66.48 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.0 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.507 ' CD ' ' HD3' ' B' ' 96' ' ' PRO . 21.4 tptm -56.37 -44.49 80.2 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 125.035 1.334 . . . . 0.0 111.587 178.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.532 ' HB1' HG21 ' A' ' 91' ' ' VAL . . . -63.22 -32.93 74.46 Favored 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.637 -178.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.635 ' HE3' ' O ' ' B' ' 89' ' ' ILE . 8.5 mtmp? -99.67 -11.26 21.06 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -174.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -164.25 117.06 1.36 Allowed 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 -175.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -58.61 147.82 68.87 Favored Pre-proline 0 CA--C 1.492 -1.263 0 CA-C-O 117.853 -1.07 . . . . 0.0 108.717 -174.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.507 ' HD3' ' CD ' ' B' ' 91' ' ' LYS . 36.1 Cg_exo 2.92 73.68 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.111 1 C-N-CA 125.836 4.357 . . . . 0.0 114.347 -162.508 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . 0.435 ' CG ' ' HZ1' ' A' ' 75' ' ' LYS . 15.2 t70 -53.14 110.38 1.97 Allowed Pre-proline 0 C--O 1.241 0.626 0 CA-C-N 113.003 -1.908 . . . . 0.0 111.16 -173.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -73.93 93.98 0.88 Allowed 'Trans proline' 0 N--CA 1.442 -1.531 0 C-N-CA 122.247 1.965 . . . . 0.0 109.599 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . 0.427 ' HB2' ' OD1' ' B' ' 97' ' ' ASP . 42.9 t90 -126.47 116.57 21.33 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -175.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . 0.402 ' HA ' ' CZ ' ' A' ' 19' ' ' PHE . . . . . . . . 0 C--N 1.282 -2.343 0 O-C-N 124.15 0.906 . . . . 0.0 109.356 -176.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.674 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -133.08 -18.48 2.31 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 120.682 0.277 . . . . 0.0 110.649 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.0 mm-40 -80.23 131.54 35.71 Favored 'General case' 0 C--O 1.248 1.024 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.41 ' HB3' HD11 ' A' ' 9' ' ' ILE . 12.8 tp -132.39 165.97 23.04 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 -176.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.7 p -90.12 143.82 26.44 Favored 'General case' 0 C--N 1.303 -1.42 0 C-N-CA 122.877 0.471 . . . . 0.0 111.718 -178.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 2.4 mp0 -46.54 -55.12 8.06 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 125.606 1.562 . . . . 0.0 113.342 -175.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -61.39 -40.8 95.68 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.188 0.595 . . . . 0.0 111.074 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.44 ' O ' ' HD2' ' A' ' 12' ' ' PHE . 6.3 tp-100 -65.81 -41.65 91.61 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.494 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 69.4 mt -63.33 -35.61 72.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.556 177.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.92 -39.12 87.29 Favored 'General case' 0 C--O 1.257 1.449 0 CA-C-O 121.093 0.473 . . . . 0.0 110.576 177.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -60.22 -48.38 81.98 Favored 'General case' 0 C--O 1.247 0.945 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 175.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.44 ' HD2' ' O ' ' A' ' 8' ' ' GLN . 28.2 m-85 -56.6 -46.52 80.82 Favored 'General case' 0 C--O 1.184 -2.393 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.727 175.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 33.9 mmtp -46.82 -49.83 19.38 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.501 0.721 . . . . 0.0 112.073 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -65.51 -57.27 8.64 Favored 'General case' 0 C--O 1.255 1.379 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.074 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.519 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -68.15 -28.54 67.39 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.806 -175.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -61.8 -42.58 99.19 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 123.176 0.59 . . . . 0.0 109.78 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.4 m -72.59 -18.23 61.62 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.111 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.519 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 62.8 tp -68.9 -42.18 77.23 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.099 0.475 . . . . 0.0 110.198 172.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -78.95 -35.97 42.37 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.143 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -77.17 99.32 5.38 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.683 175.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -74.42 -3.08 28.4 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.331 -0.85 . . . . 0.0 113.277 -174.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.415 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 21.6 m-20 -110.95 -13.26 14.14 Favored 'General case' 0 CA--C 1.49 -1.363 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.729 -179.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.41 23.18 68.23 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 -176.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.415 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 3.9 p-10 -97.25 -16.36 20.39 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.891 0.377 . . . . 0.0 110.044 -173.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 101.98 8.35 45.17 Favored Glycine 0 N--CA 1.427 -1.935 0 N-CA-C 114.851 0.701 . . . . 0.0 114.851 176.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.4 p -130.53 136.55 49.05 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 118.471 1.136 . . . . 0.0 109.628 177.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.1 mt -102.89 114.64 43.05 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 176.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.0 p -87.12 172.24 10.1 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.469 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.8 p -65.79 -32.83 74.58 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.128 0.489 . . . . 0.0 110.218 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -62.43 -45.95 90.76 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.589 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -66.6 -41.65 88.09 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.74 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.475 HD22 ' HB3' ' B' ' 96' ' ' PRO . 89.7 mt -55.64 -62.1 1.91 Allowed 'General case' 0 CA--C 1.501 -0.929 0 O-C-N 124.006 0.816 . . . . 0.0 109.874 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -59.4 -29.12 65.75 Favored Glycine 0 C--O 1.2 -1.974 0 C-N-CA 121.18 -0.533 . . . . 0.0 113.422 -175.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.1 m -73.61 -46.2 48.4 Favored 'General case' 0 CA--C 1.554 1.128 0 CA-C-N 117.606 0.703 . . . . 0.0 111.354 178.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.97 -28.21 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 121.771 0.796 . . . . 0.0 109.97 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.692 ' SD ' ' HA ' ' B' ' 96' ' ' PRO . 48.3 mtp -77.68 -28.73 51.16 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.344 177.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 80.3 ttt180 -68.57 -29.08 67.55 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 176.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.0 m -65.2 -35.45 81.1 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.157 173.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -82.65 -22.44 34.64 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.142 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.74 25.02 5.59 Favored Glycine 0 N--CA 1.435 -1.414 0 C-N-CA 120.816 -0.706 . . . . 0.0 114.236 178.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.417 ' HG2' ' HD3' ' A' ' 43' ' ' PRO . 7.6 tt0 -139.53 122.6 16.8 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 118.105 0.953 . . . . 0.0 109.476 176.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -141.11 89.85 9.52 Favored Pre-proline 0 C--N 1.298 -1.64 0 CA-C-O 121.71 0.766 . . . . 0.0 111.334 174.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.417 ' HD3' ' HG2' ' A' ' 41' ' ' GLN . 22.2 Cg_endo -75.95 172.42 16.31 Favored 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.785 2.324 . . . . 0.0 112.126 178.204 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 p -73.07 164.33 26.85 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.941 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -52.76 -46.81 67.67 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.802 1.241 . . . . 0.0 111.095 -176.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.46 -43.4 83.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.289 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -64.19 -43.14 95.97 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.25 0.548 . . . . 0.0 110.546 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.2 mt -68.55 -47.08 67.77 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.76 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -58.67 -46.1 87.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.47 0.653 . . . . 0.0 109.531 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -62.57 -30.86 71.63 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.6 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 34.9 tpp -83.04 -39.51 21.14 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.9 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.406 HG22 ' HB2' ' A' ' 56' ' ' ASP . 42.4 mt -57.74 -42.98 83.0 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 176.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -56.05 -18.42 9.54 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 124.272 1.029 . . . . 0.0 113.546 -177.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -70.14 -43.76 70.25 Favored 'General case' 0 N--CA 1.393 -3.323 0 O-C-N 121.667 -0.646 . . . . 0.0 110.717 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.575 HG11 ' HB2' ' A' ' 71' ' ' MET . 12.2 m -95.29 -25.29 4.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.202 0.525 . . . . 0.0 110.095 -177.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.406 ' HB2' HG22 ' A' ' 52' ' ' ILE . 25.9 t0 -67.86 115.94 7.96 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.776 -176.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.12 -27.99 57.29 Favored 'General case' 0 C--N 1.291 -1.966 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.155 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -94.55 -12.45 27.55 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -174.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 55.03 37.56 63.36 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -173.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.5 p-10 -104.04 -7.58 20.19 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -171.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 99.78 23.18 11.08 Favored Glycine 0 C--N 1.307 -1.052 0 C-N-CA 120.195 -1.002 . . . . 0.0 113.818 172.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.55 132.66 21.61 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 116.819 0.31 . . . . 0.0 110.484 177.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 52.6 mt -92.39 110.05 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 176.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -85.34 178.43 7.47 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.401 ' CE2' HD11 ' A' ' 69' ' ' LEU . 67.1 t80 -63.07 -54.79 43.04 Favored Pre-proline 0 C--N 1.298 -1.649 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -174.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -52.11 -40.05 69.38 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.616 2.21 . . . . 0.0 112.654 175.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -66.12 -40.85 90.99 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.4 0.619 . . . . 0.0 109.795 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.524 ' CZ ' ' HB3' ' B' ' 100' ' ' ALA . 5.3 t80 -64.18 -40.88 97.05 Favored 'General case' 0 C--O 1.245 0.826 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.94 177.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.401 HD11 ' CE2' ' A' ' 65' ' ' PHE . 81.1 mt -61.05 -48.45 81.68 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.56 176.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.6 m -56.92 -44.66 82.65 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 123.427 0.454 . . . . 0.0 110.257 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.575 ' HB2' HG11 ' A' ' 55' ' ' VAL . 30.5 ttp -56.99 -44.68 82.98 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.4 mmt -85.8 -32.54 21.73 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 119.086 -1.046 . . . . 0.0 112.52 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.26 -40.42 97.37 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 74' ' ' ARG . 2.5 ptm180 -66.07 -26.21 67.39 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 121.848 0.832 . . . . 0.0 110.364 178.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -87.28 -28.99 21.97 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 114.626 -1.17 . . . . 0.0 109.389 -176.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.3 ttm -76.47 -67.06 0.73 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.53 -1.213 . . . . 0.0 111.479 -177.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -100.39 90.68 4.39 Favored 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -174.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 54.65 99.43 0.01 OUTLIER 'General case' 0 CA--C 1.49 -1.333 0 O-C-N 124.806 1.316 . . . . 0.0 114.092 175.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.7 t -83.01 61.54 6.06 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-O 122.427 1.108 . . . . 0.0 109.157 174.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -81.32 80.79 7.66 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 122.531 1.157 . . . . 0.0 108.147 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 50.3 m -175.53 -28.86 0.01 OUTLIER 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 104.421 -2.437 . . . . 0.0 104.421 -173.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.44 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 2.1 mp0 63.48 23.55 13.71 Favored 'General case' 0 C--N 1.36 1.042 0 CA-C-N 113.595 -1.639 . . . . 0.0 112.197 175.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 45.0 mt-10 -65.06 -59.56 4.0 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -52.93 -39.75 63.09 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.257 1.027 . . . . 0.0 109.496 176.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.4 mm -67.63 -51.26 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-N 113.376 -1.738 . . . . 0.0 110.354 -173.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 42.8 ttm105 -71.92 -30.99 65.92 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.338 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 47.6 mt-10 -61.28 -44.77 96.67 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.501 0.667 . . . . 0.0 110.181 174.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.46 -34.17 75.47 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.347 178.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -66.89 -50.32 62.84 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.946 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -66.43 -19.72 65.87 Favored 'General case' 0 N--CA 1.419 -1.998 0 C-N-CA 123.454 0.702 . . . . 0.0 112.767 -176.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.4 p -83.15 -28.72 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 C-N-CA 118.724 -1.191 . . . . 0.0 111.006 176.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -83.52 -48.19 10.54 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 177.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -75.87 105.33 6.85 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 175.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -77.88 -16.98 57.84 Favored 'General case' 0 C--N 1.288 -2.093 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -169.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -115.01 -13.06 11.91 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 120.262 -0.575 . . . . 0.0 111.939 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.83 55.75 5.22 Favored Glycine 0 N--CA 1.437 -1.262 0 N-CA-C 108.327 -1.909 . . . . 0.0 108.327 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -100.69 -18.47 16.51 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.065 0.46 . . . . 0.0 110.44 -174.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.64 11.99 59.99 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.256 -1.137 . . . . 0.0 110.256 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -147.46 130.59 16.4 Favored 'General case' 0 CA--C 1.498 -1.024 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -176.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.47 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.4 mt -104.74 132.63 50.99 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 175.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.3 p -109.82 160.09 16.65 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.481 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.84 -46.34 82.35 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -175.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.65 -42.5 98.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.181 0.515 . . . . 0.0 109.87 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -61.62 -40.13 93.77 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.518 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 121' ' ' VAL . 4.0 tt -61.56 -43.55 98.65 Favored 'General case' 0 N--CA 1.438 -1.034 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.594 ' HG3' HG21 ' A' ' 121' ' ' VAL . 31.0 mtm180 -60.89 -40.49 93.22 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 121.249 -0.181 . . . . 0.0 111.473 174.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -57.24 -50.82 71.68 Favored 'General case' 0 C--O 1.244 0.802 0 O-C-N 123.174 0.297 . . . . 0.0 111.523 178.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.2 p -68.6 -34.42 65.1 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 C-N-CA 119.819 -0.753 . . . . 0.0 110.06 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.458 ' HG3' HD12 ' A' ' 116' ' ' LEU . 23.3 mmt -65.7 -36.28 83.17 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 58.3 m -63.08 -36.9 85.13 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -69.12 -35.01 75.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.267 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 80.0 mt -87.5 -20.49 26.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -172.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 71.07 32.21 66.05 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 116.335 -0.393 . . . . 0.0 112.279 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -81.14 -25.12 37.13 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -178.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt 69.55 71.92 0.24 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.887 0.875 . . . . 0.0 111.0 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.458 HD12 ' HG3' ' A' ' 109' ' ' MET . 32.6 mt -118.61 130.58 55.96 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 37.8 p -83.47 174.09 10.92 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.909 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -57.12 -44.16 83.04 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 122.939 0.496 . . . . 0.0 111.013 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -55.57 -44.65 77.08 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 123.765 0.666 . . . . 0.0 111.251 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -69.52 -48.91 58.96 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.824 -175.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.594 HG21 ' HG3' ' A' ' 106' ' ' ARG . 7.3 m -67.88 -34.23 66.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.314 -177.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -69.87 -40.13 75.92 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.229 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 11.1 tp10 -65.62 -42.14 91.91 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 54.1 mtt -57.3 -50.91 71.43 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.65 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 121' ' ' VAL . 42.8 mm -56.01 -47.16 80.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -63.05 -29.97 71.23 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 123' ' ' GLU . 49.1 mt-10 -70.49 -42.42 71.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.016 0.436 . . . . 0.0 110.296 177.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.429 ' O ' ' HB3' ' A' ' 140' ' ' GLU . . . -81.55 -33.38 31.74 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.22 -0.446 . . . . 0.0 112.01 -176.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -68.37 107.3 2.8 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 123.894 0.878 . . . . 0.0 109.975 177.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 68.9 mt -82.54 -42.41 18.38 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.752 -177.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -76.02 -11.79 60.01 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.007 0.432 . . . . 0.0 112.046 -174.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 68.84 46.98 58.15 Favored Glycine 0 N--CA 1.44 -1.063 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -99.61 -16.18 18.32 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 121.412 0.625 . . . . 0.0 110.51 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.22 -4.2 58.54 Favored Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.989 -0.624 . . . . 0.0 111.742 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -135.76 142.44 44.96 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.47 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.6 OUTLIER -100.28 126.57 53.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 O-C-N 123.595 0.559 . . . . 0.0 111.086 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -85.22 169.02 14.22 Favored 'General case' 0 CA--C 1.501 -0.908 0 O-C-N 123.679 0.612 . . . . 0.0 110.57 177.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.538 ' O ' HG13 ' A' ' 142' ' ' VAL . 92.0 t80 -60.14 -45.46 92.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.302 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.43 ' O ' HG22 ' A' ' 142' ' ' VAL . 4.1 mp0 -62.46 -29.95 70.9 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.695 0.798 . . . . 0.0 111.276 -179.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HB3' ' O ' ' A' ' 128' ' ' ALA . 47.4 mt-10 -82.57 -35.71 26.89 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.198 0.523 . . . . 0.0 109.736 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -69.4 -39.36 77.99 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.341 178.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.538 HG13 ' O ' ' A' ' 138' ' ' TYR . 19.5 m -58.58 -34.79 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-O 120.701 0.286 . . . . 0.0 110.524 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.41 HE21 ' HB3' ' A' ' 143' ' ' GLN . 0.9 OUTLIER -59.92 -40.86 90.3 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.364 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 70.2 mtp -86.38 -36.08 19.41 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 17.2 tpt -60.37 -40.28 90.26 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.625 -177.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . 0.497 HG22 ' O ' ' A' ' 142' ' ' VAL . 14.5 t -94.72 11.99 29.38 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.753 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -96.53 173.91 7.11 Favored 'General case' 0 C--O 1.244 0.776 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 23.8 pttm . . . . . 0 C--N 1.303 -1.44 0 CA-C-O 119.192 -0.433 . . . . 0.0 109.919 178.837 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 45.8 t . . . . . 0 C--O 1.243 0.721 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -55.47 -52.14 8.34 Favored 'Trans proline' 0 C--N 1.359 1.101 0 C-N-CA 123.226 2.617 . . . . 0.0 111.344 176.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.26 133.04 34.15 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -60.5 -36.89 79.42 Favored 'General case' 0 C--N 1.31 -1.127 0 O-C-N 123.473 0.483 . . . . 0.0 112.232 -175.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 15.0 m -89.19 -17.84 28.32 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.113 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 53.3 t80 61.21 99.19 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.191 0.996 . . . . 0.0 108.847 -172.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 15.9 t60 171.82 -38.16 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -172.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -82.99 -48.3 10.8 Favored 'General case' 0 C--O 1.206 -1.187 0 N-CA-C 115.582 1.697 . . . . 0.0 115.582 -171.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -59.8 -38.34 81.64 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-O 122.36 1.076 . . . . 0.0 109.14 178.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . 0.457 ' CD ' ' H ' ' B' ' 83' ' ' GLU . 11.8 mp0 -63.22 -49.01 75.86 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 113.209 -1.814 . . . . 0.0 108.787 178.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.27 -32.53 72.76 Favored 'General case' 0 C--O 1.192 -1.971 0 CA-C-N 115.187 -0.915 . . . . 0.0 112.09 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 71.2 m95 -64.01 -43.39 95.79 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-N 118.228 0.467 . . . . 0.0 111.74 177.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -62.82 -46.26 88.8 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -60.32 -44.51 95.4 Favored 'General case' 0 C--O 1.205 -1.245 0 CA-C-N 114.078 -1.419 . . . . 0.0 111.873 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.7 -54.41 47.43 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 123.579 0.752 . . . . 0.0 112.149 -178.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 35.3 pt -64.82 -32.21 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 121.289 0.566 . . . . 0.0 111.274 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -69.09 -51.58 37.16 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.336 177.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.408 ' HG3' ' HB3' ' A' ' 112' ' ' LEU . 4.1 tppp? -67.48 -45.19 76.6 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 123.443 0.697 . . . . 0.0 111.77 -178.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.59 -51.35 70.21 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.089 -176.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.534 ' HE2' ' SD ' ' B' ' 95' ' ' MET . 51.3 mtpt -78.47 -8.86 58.98 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.065 178.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 59.98 45.48 12.11 Favored 'General case' 0 CA--C 1.496 -1.13 0 CA-C-O 122.194 0.997 . . . . 0.0 108.497 -175.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.534 ' SD ' ' HE2' ' B' ' 93' ' ' LYS . 95.7 mmm -65.89 124.6 88.07 Favored Pre-proline 0 N--CA 1.422 -1.853 0 CA-C-N 113.359 -1.746 . . . . 0.0 110.704 -177.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.692 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 36.5 Cg_exo -64.03 -38.06 39.51 Favored 'Trans proline' 0 N--CA 1.433 -2.052 0 N-CA-C 107.107 -1.92 . . . . 0.0 107.107 168.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . 0.452 ' HB2' ' HB3' ' B' ' 95' ' ' MET . 7.0 t70 40.65 64.08 5.11 Favored Pre-proline 0 C--O 1.209 -1.034 0 CA-C-N 112.77 -2.014 . . . . 0.0 109.521 178.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.61 106.06 0.23 Allowed 'Trans proline' 0 C--N 1.361 1.185 0 C-N-CA 122.149 1.899 . . . . 0.0 111.986 -173.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 8.2 m-90 -76.68 44.07 0.35 Allowed 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 124.209 1.004 . . . . 0.0 109.997 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . 0.524 ' HB3' ' CZ ' ' A' ' 68' ' ' PHE . . . . . . . . 0 N--CA 1.393 -3.287 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.364 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -95.81 -62.79 1.23 Allowed 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.657 ' HA ' HE21 ' A' ' 3' ' ' GLN . 0.0 OUTLIER 64.73 70.99 0.47 Allowed 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.771 1.229 . . . . 0.0 109.839 -174.167 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.541 HD23 HG12 ' A' ' 9' ' ' ILE . 12.3 tp -126.01 150.84 47.79 Favored 'General case' 0 N--CA 1.422 -1.826 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.1 p -78.2 143.52 37.09 Favored 'General case' 0 N--CA 1.421 -1.896 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.099 179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -55.73 -45.16 78.03 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.348 1.059 . . . . 0.0 112.512 -175.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.5 -41.18 96.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.023 0.44 . . . . 0.0 109.985 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -63.85 -42.51 97.56 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.846 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.578 HG22 ' HE3' ' A' ' 13' ' ' LYS . 65.4 mt -63.55 -37.38 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.991 176.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.68 -41.73 99.25 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.436 177.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -61.58 -44.19 97.48 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.608 175.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -59.53 -48.69 80.69 Favored 'General case' 0 C--O 1.197 -1.658 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.402 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE3' HG22 ' A' ' 9' ' ' ILE . 98.3 mttt -50.09 -43.87 51.72 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 122.966 0.506 . . . . 0.0 111.99 179.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.86 -59.44 3.29 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.405 -177.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.83 -33.6 75.09 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -175.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -63.51 -45.2 91.76 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 123.029 0.532 . . . . 0.0 110.029 178.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.8 m -74.11 -16.43 61.01 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.276 0.56 . . . . 0.0 110.966 178.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -79.13 -54.18 6.25 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.311 176.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -80.48 -20.73 43.04 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -174.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -67.81 101.08 1.01 Allowed 'General case' 0 CA--C 1.496 -1.108 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 171.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -62.3 -7.7 4.71 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 116.083 1.883 . . . . 0.0 116.083 -171.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -109.95 -13.82 14.36 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.04 29.78 75.66 Favored Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.105 -176.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -104.34 -17.76 14.69 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 120.021 -0.671 . . . . 0.0 110.719 -176.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.95 4.16 63.45 Favored Glycine 0 N--CA 1.431 -1.693 0 C-N-CA 119.661 -1.257 . . . . 0.0 115.123 176.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.0 p -124.73 129.76 51.1 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 119.239 1.52 . . . . 0.0 109.582 170.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.9 mt -91.07 126.99 43.75 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.752 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.389 -174.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 25.9 p -102.57 167.01 10.2 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.15 173.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.8 p -53.73 -45.54 70.54 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 123.886 0.874 . . . . 0.0 113.005 -178.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -59.61 -34.98 73.45 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.495 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -70.35 -38.48 74.82 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.043 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.97 -47.87 84.46 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 175.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.44 ' O ' ' HB2' ' A' ' 37' ' ' ARG . . . -64.28 -26.48 70.59 Favored Glycine 0 C--O 1.198 -2.151 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.473 179.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.7 m -68.99 -49.8 54.61 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 117.582 0.691 . . . . 0.0 110.565 179.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 30.4 m -70.62 -29.68 39.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.409 -0.516 . . . . 0.0 111.135 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.427 ' HG2' ' SD ' ' B' ' 95' ' ' MET . 66.9 mtt -69.13 -42.86 75.46 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 174.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 33' ' ' GLY . 40.5 ttm180 -56.3 -39.57 72.95 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.344 1.458 . . . . 0.0 109.461 178.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 m -65.58 -32.64 74.33 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.141 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.462 HD12 ' SD ' ' B' ' 95' ' ' MET . 82.6 mt -87.97 -13.73 40.99 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.226 0.536 . . . . 0.0 110.275 178.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.74 47.11 2.36 Favored Glycine 0 N--CA 1.44 -1.064 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.783 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.43 ' HB2' ' HE2' ' B' ' 91' ' ' LYS . 50.1 tt0 -148.5 130.29 15.13 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 176.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -132.54 82.4 57.03 Favored Pre-proline 0 C--N 1.286 -2.175 0 C-N-CA 120.258 -0.577 . . . . 0.0 112.046 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -70.36 160.87 48.06 Favored 'Trans proline' 0 C--O 1.243 0.771 0 C-N-CA 122.581 2.187 . . . . 0.0 109.657 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.5 t -80.81 157.38 25.75 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.725 -176.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.82 -31.11 62.39 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.09 -42.66 95.13 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.726 0.298 . . . . 0.0 111.029 176.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 51' ' ' MET . 40.7 mt-10 -66.79 -43.25 84.44 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.459 0.647 . . . . 0.0 109.295 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 66.1 mt -64.31 -38.27 90.46 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.71 -178.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -66.33 -39.07 89.0 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.567 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.41 -38.99 88.69 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.677 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.408 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 24.4 mmt -60.83 -40.38 92.55 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.228 176.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.7 mt -66.19 -47.04 85.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.953 177.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.475 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.7 t30 -64.62 -12.61 47.45 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.797 -173.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -61.84 -40.17 94.36 Favored 'General case' 0 N--CA 1.392 -3.367 0 C-N-CA 123.861 0.864 . . . . 0.0 110.428 175.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.844 HG11 ' HB2' ' A' ' 71' ' ' MET . 19.3 m -112.21 -10.94 11.94 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.813 -178.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.475 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 24.3 t0 -73.53 103.23 4.08 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.371 0.605 . . . . 0.0 110.859 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.49 -11.12 49.89 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.023 -0.989 . . . . 0.0 111.693 -177.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -93.32 -11.49 32.29 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 119.869 -0.732 . . . . 0.0 110.566 -176.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 61.44 36.38 92.45 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -115.65 -12.14 11.6 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 122.732 -0.275 . . . . 0.0 110.967 -177.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.11 17.19 32.86 Favored Glycine 0 N--CA 1.434 -1.492 0 N-CA-C 115.373 0.909 . . . . 0.0 115.373 173.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 27.1 p -132.48 143.14 49.56 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-N 118.39 1.095 . . . . 0.0 111.49 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.9 mt -92.36 112.96 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -84.41 161.29 20.39 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 177.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.423 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 74.7 t80 -55.56 -50.04 89.22 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.685 0.394 . . . . 0.0 111.567 177.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.423 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 4.8 Cg_endo -49.68 -43.85 38.24 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 122.494 2.129 . . . . 0.0 112.671 173.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -71.78 -36.78 70.44 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.475 0.655 . . . . 0.0 110.045 -178.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -61.87 -43.82 98.06 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.751 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.1 mt -61.16 -45.45 94.6 Favored 'General case' 0 C--O 1.208 -1.131 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.269 178.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.5 m -57.12 -40.6 77.4 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 123.601 0.563 . . . . 0.0 110.536 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.844 ' HB2' HG11 ' A' ' 55' ' ' VAL . 27.5 ttp -55.51 -55.84 27.25 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.066 0.947 . . . . 0.0 112.143 -179.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -79.5 -38.55 34.13 Favored 'General case' 0 C--O 1.196 -1.711 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.26 -33.87 74.23 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -176.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -83.54 -19.17 36.15 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.896 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -83.07 -48.08 10.98 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.447 ' HA ' ' OG1' ' A' ' 79' ' ' THR 0.262 1.8 ppp? -103.91 104.77 14.8 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 122.397 1.094 . . . . 0.0 113.388 -179.668 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 52.6 mttp -119.18 -66.83 1.03 Allowed 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 175.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -140.79 30.51 1.86 Allowed 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 124.137 1.922 . . . . 0.0 105.869 178.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.564 HG23 ' HB2' ' A' ' 83' ' ' GLU . 61.1 m -64.71 -5.25 5.38 Favored 'General case' 0 C--N 1.283 -2.292 0 C-N-CA 129.454 3.102 . . . . 0.0 113.111 -174.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.94 -27.65 66.79 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 125.086 1.354 . . . . 0.0 109.901 -178.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.3 m -74.2 -51.42 15.51 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.506 -172.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -149.76 -38.81 0.15 Allowed 'General case' 0 C--O 1.205 -1.273 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 8.5 mm-40 -41.76 -59.6 1.62 Allowed 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 116.115 1.894 . . . . 0.0 116.115 -168.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -85.38 -24.78 27.41 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-O 121.908 0.861 . . . . 0.0 109.619 -175.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.45 HG23 ' HG2' ' A' ' 145' ' ' MET . 6.6 mm -73.46 -40.92 56.48 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.025 0 CA-C-N 114.436 -1.256 . . . . 0.0 108.762 -172.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -73.75 -26.67 60.78 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.855 178.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.565 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 43.1 mt-10 -64.02 -44.16 93.43 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 173.308 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -66.88 -37.01 83.6 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 114.552 -1.204 . . . . 0.0 110.803 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -72.18 -46.24 57.12 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.634 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.2 mtm180 -69.8 -18.28 63.46 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -177.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.475 HG12 ' O ' ' A' ' 88' ' ' ALA . 9.0 p -75.92 -20.57 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.037 178.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -97.0 -55.12 2.96 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -84.44 79.07 9.69 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-O 122.897 1.332 . . . . 0.0 109.367 176.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -78.59 -18.36 54.71 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 113.289 -1.778 . . . . 0.0 111.482 -176.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -91.33 -12.49 34.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.889 -177.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.83 45.79 49.74 Favored Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -94.86 -14.65 24.37 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.414 0.626 . . . . 0.0 109.967 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.18 8.09 82.22 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.552 177.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -142.95 138.95 30.48 Favored 'General case' 0 CA--C 1.491 -1.327 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -178.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.557 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.1 mt -97.56 124.98 50.8 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 174.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.6 m -102.02 150.53 23.13 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 123.831 0.707 . . . . 0.0 110.221 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.44 -45.06 81.1 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -175.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.74 -41.08 85.64 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 122.63 0.372 . . . . 0.0 110.752 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -59.15 -55.85 29.75 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.137 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.577 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.6 tt -59.93 -40.55 89.3 Favored 'General case' 0 N--CA 1.415 -2.222 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.294 -172.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.448 ' HB2' HG21 ' A' ' 121' ' ' VAL . 0.0 OUTLIER -65.29 -38.87 91.57 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -63.07 -51.02 68.29 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.285 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.546 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.9 p -65.87 -31.51 54.06 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.38 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.371 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.577 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.4 mmt -62.55 -37.1 84.82 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 13.8 m -60.68 -46.55 89.92 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 175.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -69.08 -16.73 63.75 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 114.622 -1.172 . . . . 0.0 111.814 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 95.3 mt -100.9 -2.36 32.19 Favored 'General case' 0 C--N 1.316 -0.889 0 O-C-N 121.985 -0.447 . . . . 0.0 111.617 -177.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 81.02 1.24 89.84 Favored Glycine 0 C--O 1.237 0.301 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.466 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.436 ' HG3' ' SD ' ' A' ' 109' ' ' MET . 20.4 mm-40 -70.9 -48.69 52.32 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 52.08 73.47 0.32 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 124.519 1.137 . . . . 0.0 110.665 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.423 HD12 ' HG3' ' A' ' 109' ' ' MET . 82.1 mt -97.5 157.64 15.9 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.166 -177.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.4 p -76.82 158.64 30.7 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.497 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.407 ' HA ' HG22 ' A' ' 121' ' ' VAL . 3.9 p30 -67.84 -23.09 65.12 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-O 121.112 0.482 . . . . 0.0 109.892 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.81 -42.83 63.44 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 123.158 0.583 . . . . 0.0 110.375 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -68.22 -44.5 75.6 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.335 0.588 . . . . 0.0 109.863 -176.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.448 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.4 m -69.07 -29.58 43.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.143 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.84 -41.15 92.11 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.8 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -63.85 -43.51 95.94 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.425 ' HA ' ' CE2' ' B' ' 81' ' ' PHE . 55.4 mtt -53.89 -34.8 60.53 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.413 178.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.421 ' CG2' ' HA ' ' A' ' 135' ' ' GLN . 51.3 mm -86.23 -58.52 3.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.46 179.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.62 -38.35 86.75 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -171.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -70.15 -28.65 65.52 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.419 ' HA ' ' SD ' ' A' ' 144' ' ' MET . . . -80.18 -35.76 35.97 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.221 179.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.67 85.56 0.65 Allowed 'General case' 0 C--N 1.307 -1.276 0 CA-C-O 122.582 1.182 . . . . 0.0 112.424 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 28.9 mt -83.44 -8.74 11.41 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 CA-C-N 114.078 -1.419 . . . . 0.0 109.106 174.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.422 ' HB2' ' OE2' ' A' ' 140' ' ' GLU . 31.8 t70 -90.15 -12.47 38.11 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.607 -172.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.79 35.68 58.41 Favored Glycine 0 N--CA 1.433 -1.551 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.611 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -100.35 -16.87 17.5 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.444 0.64 . . . . 0.0 109.772 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.95 -2.28 85.53 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.121 -1.192 . . . . 0.0 110.121 -176.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.421 ' HA ' ' CG2' ' A' ' 125' ' ' ILE . 21.9 mt-30 -138.37 147.29 43.27 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.634 1.173 . . . . 0.0 108.803 -178.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.557 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.4 p -86.69 121.11 37.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 C-N-CA 119.811 -0.756 . . . . 0.0 110.879 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -91.54 177.07 6.32 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.987 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.404 ' O ' HG13 ' A' ' 142' ' ' VAL . 85.5 t80 -70.05 -41.6 73.98 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.984 -173.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.411 ' HA ' HG22 ' A' ' 142' ' ' VAL . 44.7 mt-10 -63.94 -42.13 97.43 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.095 0.474 . . . . 0.0 111.408 -179.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.422 ' OE2' ' HB2' ' A' ' 131' ' ' ASP . 0.5 OUTLIER -70.48 -30.66 67.51 Favored 'General case' 0 C--N 1.306 -1.312 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.835 177.347 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -70.75 -45.37 64.94 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.054 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.411 HG22 ' HA ' ' A' ' 139' ' ' GLU . 23.9 m -62.45 -33.91 61.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-O 120.927 0.394 . . . . 0.0 110.828 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -60.9 -46.41 90.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.966 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.419 ' SD ' ' HA ' ' A' ' 128' ' ' ALA . 40.1 mtm -75.23 -40.17 59.29 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.693 -178.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.45 ' HG2' HG23 ' A' ' 85' ' ' ILE . 10.0 tpt -61.22 -32.29 72.06 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.508 -175.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 22.9 p -89.52 -10.86 44.63 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-O 121.284 0.564 . . . . 0.0 111.703 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -108.95 27.46 9.47 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 122.77 1.271 . . . . 0.0 108.172 178.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.589 ' NZ ' ' HB3' ' A' ' 148' ' ' LYS . 0.8 OUTLIER . . . . . 0 C--N 1.281 -2.41 0 CA-C-N 113.759 -1.564 . . . . 0.0 108.632 -176.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 22.4 m . . . . . 0 N--CA 1.437 -1.087 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -63.14 145.74 93.83 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 121.995 1.797 . . . . 0.0 110.234 177.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -54.18 -48.26 71.14 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.311 0.645 . . . . 0.0 112.114 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -65.53 -42.58 91.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.382 -179.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 13.5 m -68.02 -36.23 79.6 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.011 0.434 . . . . 0.0 110.584 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -66.66 -49.51 65.94 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 178.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 25.4 t-80 -60.3 -38.54 83.97 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . 0.425 ' CE2' ' HA ' ' A' ' 124' ' ' MET . 12.6 t80 -56.05 -52.47 64.14 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 124.314 1.046 . . . . 0.0 111.451 175.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -69.35 -25.77 64.35 Favored 'General case' 0 C--O 1.247 0.947 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -177.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -80.26 -44.06 20.29 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.099 0.476 . . . . 0.0 110.147 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.84 -37.16 83.43 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.055 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.443 ' O ' HG13 ' B' ' 89' ' ' ILE . 48.2 m95 -57.56 -45.66 84.87 Favored 'General case' 0 C--O 1.206 -1.235 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 176.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -55.56 -49.51 72.48 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 122.512 1.149 . . . . 0.0 109.811 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -66.41 -36.6 83.25 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 113.149 -1.841 . . . . 0.0 111.195 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -77.44 -41.28 40.36 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.443 HG13 ' O ' ' B' ' 85' ' ' TRP . 83.1 mt -57.85 -50.99 75.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 122.943 0.497 . . . . 0.0 111.886 -178.169 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -68.18 -31.39 70.9 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.615 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' A' ' 112' ' ' LEU . 3.6 tppp? -65.99 -46.29 78.53 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.839 177.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.81 -39.69 92.63 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.265 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -68.75 -13.6 62.49 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.299 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.401 ' HA ' HE22 ' A' ' 41' ' ' GLN . 58.4 m80 72.11 19.68 4.49 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.236 1.014 . . . . 0.0 110.199 -177.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.462 ' SD ' HD12 ' A' ' 39' ' ' LEU . 75.3 mtp 51.14 78.82 0.38 Allowed Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 114.538 1.31 . . . . 0.0 114.538 -177.063 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -88.88 6.7 4.56 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.455 2.104 . . . . 0.0 109.441 175.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -132.05 117.91 16.14 Favored Pre-proline 0 N--CA 1.429 -1.502 0 CA-C-N 114.201 -1.363 . . . . 0.0 108.91 -176.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -75.05 95.74 0.99 Allowed 'Trans proline' 0 N--CA 1.44 -1.623 0 N-CA-C 107.078 -1.932 . . . . 0.0 107.078 168.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 33.0 p-90 -78.62 119.62 22.14 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 -172.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.414 -2.263 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 175.504 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.257 0 CA-C-O 121.406 0.622 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.416 ' HB3' ' HA ' ' A' ' 70' ' ' THR . 1.6 p30 -86.23 91.95 8.62 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.48 1.133 . . . . 0.0 113.689 -177.087 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -103.26 113.74 27.47 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 173.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.429 HD23 HG12 ' A' ' 9' ' ' ILE . 9.3 tp -132.38 145.45 51.24 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 -177.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.0 p -82.32 145.36 29.99 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -176.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -51.08 -50.59 58.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.812 1.245 . . . . 0.0 113.371 -176.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -66.72 -34.96 79.01 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.257 0.551 . . . . 0.0 110.705 -177.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.615 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 52.0 tp60 -74.36 -36.33 63.59 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.307 -178.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.429 HG12 HD23 ' A' ' 4' ' ' LEU . 68.8 mt -60.55 -40.67 85.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.939 176.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.93 -38.81 92.5 Favored 'General case' 0 C--O 1.255 1.376 0 CA-C-O 121.334 0.588 . . . . 0.0 110.647 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -62.88 -45.51 92.19 Favored 'General case' 0 C--O 1.249 1.059 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.255 177.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.615 ' CE2' ' HG3' ' A' ' 8' ' ' GLN . 23.1 m-85 -60.45 -38.75 85.17 Favored 'General case' 0 C--O 1.197 -1.667 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.837 178.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.479 ' HG2' ' CZ ' ' A' ' 65' ' ' PHE . 98.9 mttt -55.17 -51.12 67.51 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-O 121.026 0.441 . . . . 0.0 111.304 177.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -68.04 -46.85 69.99 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.291 -178.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.606 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -70.52 -21.87 62.69 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.995 -176.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -67.51 -53.56 27.54 Favored 'General case' 0 CA--C 1.486 -1.513 0 C-N-CA 123.41 0.684 . . . . 0.0 109.408 174.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 t -67.4 -16.82 64.45 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 121.018 0.437 . . . . 0.0 110.359 -177.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.606 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 16.7 tp -59.35 -46.84 87.52 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.56 172.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.628 ' HB2' HG11 ' A' ' 35' ' ' VAL . 25.2 p90 -101.42 -25.79 13.81 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.985 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -75.98 99.15 4.47 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 174.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -48.96 -34.52 13.11 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 116.767 2.136 . . . . 0.0 116.767 -170.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.1 p30 -110.47 -13.11 14.31 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 27.58 73.66 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.813 -0.232 . . . . 0.0 112.851 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -81.65 -16.48 51.26 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.165 0.507 . . . . 0.0 110.952 -176.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.43 0.26 46.83 Favored Glycine 0 N--CA 1.434 -1.442 0 C-N-CA 120.657 -0.783 . . . . 0.0 114.252 -178.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.446 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 67.2 p -128.89 129.4 45.48 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 118.898 1.349 . . . . 0.0 109.955 173.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.6 mt -89.38 111.97 23.68 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 179.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 24.6 p -87.74 170.04 11.58 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.993 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.3 p -63.02 -33.57 75.71 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 123.019 0.2 . . . . 0.0 110.852 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -52.61 -54.82 27.92 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.253 174.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.75 -45.04 79.86 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.188 -174.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 71.5 mt -60.17 -45.68 92.28 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 178.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.98 -29.04 67.52 Favored Glycine 0 C--O 1.207 -1.532 0 C-N-CA 118.997 -1.573 . . . . 0.0 112.188 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.8 m -69.57 -44.12 71.47 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 117.255 0.528 . . . . 0.0 110.436 177.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.628 HG11 ' HB2' ' A' ' 19' ' ' PHE . 25.1 m -66.76 -36.21 76.66 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-O 121.149 0.499 . . . . 0.0 109.949 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.533 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 63.2 mtt -68.46 -42.51 78.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.607 176.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 68.5 ttt180 -62.85 -25.59 68.35 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 123.873 0.869 . . . . 0.0 110.819 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.0 m -63.09 -30.25 71.45 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.349 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -98.05 9.34 43.07 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 120.9 0.381 . . . . 0.0 111.077 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.42 -9.7 75.54 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.767 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.401 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 62.1 tt0 -71.8 118.36 14.55 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -113.41 84.43 7.7 Favored Pre-proline 0 C--N 1.289 -2.052 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 177.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.533 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 73.1 Cg_endo -89.65 162.33 5.25 Favored 'Trans proline' 0 N--CA 1.434 -2.015 0 C-N-CA 122.409 2.072 . . . . 0.0 111.237 177.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.2 p -89.13 167.53 13.05 Favored 'General case' 0 C--N 1.283 -2.297 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 175.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -64.84 -30.21 71.2 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.54 89.35 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.708 0.289 . . . . 0.0 110.834 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -66.8 -38.47 86.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.535 0.683 . . . . 0.0 110.584 179.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.409 HD21 ' HG2' ' A' ' 43' ' ' PRO . 77.1 mt -68.67 -44.8 73.27 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.149 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -63.49 -34.88 78.75 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.718 -1.128 . . . . 0.0 109.847 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.22 -43.19 98.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.707 177.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 14.6 tpt -69.06 -36.31 77.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.373 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 67.8 mt -63.31 -55.76 21.22 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.367 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.43 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -57.9 -31.8 67.12 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 123.411 0.684 . . . . 0.0 112.007 -175.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.47 -31.88 66.39 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 123.955 0.902 . . . . 0.0 110.048 178.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.644 HG11 ' SD ' ' A' ' 71' ' ' MET . 32.9 m -114.89 -11.4 12.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 O-C-N 121.825 -0.547 . . . . 0.0 112.12 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -76.26 114.55 15.06 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 -174.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.85 -10.39 53.54 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.191 -178.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -106.99 -12.37 15.45 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.717 -176.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.78 44.8 94.05 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -175.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -115.37 0.83 13.56 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -174.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.02 23.6 37.67 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.191 -1.004 . . . . 0.0 113.86 173.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.446 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 1.7 p -150.73 142.05 23.3 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 116.981 0.391 . . . . 0.0 111.364 179.03 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.3 mt -97.97 104.19 15.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 175.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.56 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 6.7 t70 -78.84 164.81 24.18 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 -178.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.479 ' CZ ' ' HG2' ' A' ' 13' ' ' LYS . 61.3 t80 -52.68 -50.39 81.06 Favored Pre-proline 0 CA--C 1.554 1.112 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.56 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 4.8 Cg_endo -49.81 -49.6 15.51 Favored 'Trans proline' 0 C--N 1.364 1.375 0 C-N-CA 122.735 2.29 . . . . 0.0 112.019 172.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -63.05 -37.98 89.37 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.268 0.556 . . . . 0.0 109.753 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.417 ' O ' ' HG2' ' A' ' 72' ' ' MET . 39.7 t80 -64.33 -39.34 93.7 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.417 178.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.9 mt -66.55 -42.49 87.05 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.416 ' HA ' ' HB3' ' A' ' 2' ' ' ASP . 86.6 m -57.53 -45.29 85.2 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.644 ' SD ' HG11 ' A' ' 55' ' ' VAL . 42.6 ttp -64.94 -37.96 89.38 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.493 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 28.7 mmt -63.91 -43.3 96.36 Favored 'General case' 0 C--N 1.321 -0.674 0 O-C-N 122.259 -0.276 . . . . 0.0 110.863 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.97 -35.05 79.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.063 0.459 . . . . 0.0 109.895 176.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -69.88 -23.73 63.3 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.327 1.051 . . . . 0.0 110.749 178.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.459 ' HD3' ' O ' ' A' ' 71' ' ' MET . 4.1 mptp? -81.03 -20.41 41.76 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 121.888 -0.508 . . . . 0.0 111.377 177.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.442 ' HG3' ' HG3' ' A' ' 77' ' ' LYS . 21.5 ptp -123.36 -32.03 3.46 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -171.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.442 ' HG3' ' HG3' ' A' ' 76' ' ' MET . 50.4 mttm -128.72 -62.39 1.02 Allowed 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.112 0.482 . . . . 0.0 111.635 -172.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -89.25 45.78 1.32 Allowed 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 122.873 1.321 . . . . 0.0 108.268 -175.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.7 m -71.65 109.75 5.77 Favored 'General case' 0 N--CA 1.406 -2.651 0 CA-C-N 114.015 -1.448 . . . . 0.0 109.096 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -69.11 -50.11 51.06 Favored 'General case' 0 CA--C 1.501 -0.931 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.971 -177.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.421 ' C ' ' H ' ' A' ' 83' ' ' GLU . 18.9 m -119.19 146.43 45.18 Favored 'General case' 0 N--CA 1.421 -1.91 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -74.64 17.79 0.19 Allowed 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.68 0.392 . . . . 0.0 111.613 -175.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.421 ' H ' ' C ' ' A' ' 81' ' ' SER . 9.2 tp10 -58.29 -50.27 74.21 Favored 'General case' 0 C--O 1.205 -1.272 0 C-N-CA 123.4 0.68 . . . . 0.0 109.448 -178.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HA ' ' HB2' ' A' ' 87' ' ' GLU . 42.8 mm-40 -64.96 -29.29 70.21 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -178.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 30.0 mm -71.67 -47.28 58.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.0 ttm-85 -70.39 -30.08 66.89 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.87 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.422 ' HB2' ' HA ' ' A' ' 84' ' ' GLU . 7.5 mm-40 -56.47 -47.4 79.29 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.965 0.906 . . . . 0.0 112.162 174.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.48 94.86 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.091 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.18 -45.55 87.89 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-O 121.351 0.596 . . . . 0.0 109.51 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -56.34 -41.79 76.65 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 126.571 1.948 . . . . 0.0 111.987 -179.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.1 p -73.39 -27.06 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.118 -177.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -84.33 -60.06 2.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.647 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -79.59 81.86 5.79 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 121.981 0.896 . . . . 0.0 110.833 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -79.1 -38.43 36.24 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.493 -1.231 . . . . 0.0 111.987 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -73.55 -13.87 61.1 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 121.28 0.562 . . . . 0.0 111.036 -176.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.41 60.25 4.15 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.993 175.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 37.5 m-80 -99.33 -10.29 22.49 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.03 0.443 . . . . 0.0 110.755 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.82 1.88 84.73 Favored Glycine 0 CA--C 1.498 -0.982 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -153.5 150.13 28.43 Favored 'General case' 0 N--CA 1.412 -2.356 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.592 ' HB ' HG13 ' A' ' 136' ' ' VAL . 5.4 mt -98.55 124.36 51.66 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.114 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.1 m -101.59 159.04 15.64 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.08 -42.12 89.67 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.16 -44.3 89.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.295 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.635 ' HA ' ' ND1' ' A' ' 107' ' ' HIS . 3.1 tp10 -59.11 -46.76 87.48 Favored 'General case' 0 CA--C 1.494 -1.184 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.898 176.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.552 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.7 tt -62.3 -36.63 82.72 Favored 'General case' 0 N--CA 1.418 -2.039 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -174.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.2 -32.53 71.88 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.635 ' ND1' ' HA ' ' A' ' 104' ' ' GLU . 48.0 m170 -53.49 -55.61 23.91 Favored 'General case' 0 C--O 1.26 1.658 0 CA-C-O 121.478 0.656 . . . . 0.0 110.117 177.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.421 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.7 p -65.79 -34.68 71.94 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.06 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.538 -178.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.552 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 19.8 mmt -62.13 -43.11 99.56 Favored 'General case' 0 CA--C 1.491 -1.324 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 m -59.43 -37.78 78.95 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.033 177.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -79.02 -22.91 44.75 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.2 177.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 93.0 mt -84.96 -20.0 31.27 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.778 0.323 . . . . 0.0 110.81 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 103.0 2.67 48.85 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.569 178.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -85.3 115.73 23.23 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.326 0.584 . . . . 0.0 111.279 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -85.8 76.13 9.95 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.454 HD12 ' HG3' ' A' ' 109' ' ' MET . 66.2 mt -101.14 147.54 26.13 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.011 -177.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.9 p -83.86 165.76 18.49 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.144 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -64.78 -39.28 93.35 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 1.5 mp0 -54.5 -49.71 69.52 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.169 176.631 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -59.4 -54.5 45.95 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.902 -176.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.456 ' O ' HG12 ' A' ' 125' ' ' ILE . 18.3 m -65.78 -35.79 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.378 -175.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.579 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 11.3 t70 -66.85 -42.06 86.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.357 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -69.92 -29.15 66.25 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.172 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.445 ' HE2' ' HB1' ' B' ' 84' ' ' ALA . 66.3 mtt -58.89 -49.66 76.95 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 173.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.9 mm -53.37 -46.44 58.07 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.603 0 CA-C-N 114.406 -1.27 . . . . 0.0 109.661 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 27.5 mmt180 -62.07 -32.34 72.86 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -175.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -79.38 -35.89 40.09 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 120.1 -0.64 . . . . 0.0 111.241 178.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.464 ' HA ' ' HG2' ' A' ' 144' ' ' MET . . . -79.81 -21.36 44.36 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 121.706 0.765 . . . . 0.0 110.467 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -82.5 88.39 6.63 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.408 173.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 61.4 mt -81.85 -42.62 19.29 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -75.8 -9.29 58.47 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -176.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.8 53.84 3.86 Favored Glycine 0 N--CA 1.438 -1.213 0 C-N-CA 120.545 -0.836 . . . . 0.0 111.813 175.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -105.38 -10.35 17.03 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 90.72 -8.81 79.25 Favored Glycine 0 CA--C 1.499 -0.941 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.115 176.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -141.35 138.3 32.97 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.592 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.8 OUTLIER -81.78 114.67 23.06 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 N-CA-C 113.159 0.799 . . . . 0.0 113.159 -175.446 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -90.66 163.62 14.46 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.779 ' O ' HG23 ' A' ' 142' ' ' VAL . 47.4 t80 -55.5 -59.92 4.15 Favored 'General case' 0 C--O 1.198 -1.62 0 CA-C-O 117.96 -1.019 . . . . 0.0 113.165 -174.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -53.71 -37.15 62.99 Favored 'General case' 0 CA--C 1.561 1.399 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -172.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -73.95 -35.07 64.52 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 120.121 -0.631 . . . . 0.0 110.44 178.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -66.51 -41.74 88.4 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.182 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 138' ' ' TYR . 6.3 t -52.6 -43.03 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.424 0 C-N-CA 124.47 1.108 . . . . 0.0 109.841 177.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -66.82 -55.92 12.7 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.92 -178.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.464 ' HG2' ' HA ' ' A' ' 128' ' ' ALA . 3.1 ppp? -76.47 -20.45 56.99 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -174.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.7 ttt -73.16 -35.39 66.44 Favored 'General case' 0 C--O 1.242 0.689 0 CA-C-O 120.971 0.415 . . . . 0.0 110.117 175.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 25.1 p -86.75 -40.51 14.95 Favored 'General case' 0 N--CA 1.435 -1.207 0 C-N-CA 119.763 -0.775 . . . . 0.0 110.186 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -96.41 89.31 5.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 121.712 0.768 . . . . 0.0 109.884 179.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.588 ' O ' ' HD2' ' A' ' 148' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.297 -1.702 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.116 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . 0.404 ' HA ' ' HD3' ' B' ' 75' ' ' PRO . 5.0 m . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' B' ' 74' ' ' SER . 3.8 Cg_exo -77.65 -82.75 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 121.661 1.574 . . . . 0.0 111.754 178.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -175.18 -174.12 0.72 Allowed 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 -179.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -137.77 -18.5 1.22 Allowed 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 120.794 0.331 . . . . 0.0 111.076 178.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.9 m -85.19 16.35 3.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.51 0.671 . . . . 0.0 111.392 -177.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 4.4 p90 -120.16 29.2 7.62 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 176.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -59.74 -24.5 64.08 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.363 -176.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -57.18 -45.48 83.66 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 174.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . 0.577 ' O ' ' HG3' ' B' ' 86' ' ' LYS . 13.0 mptt -74.27 -30.75 62.26 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.295 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -64.47 -36.97 85.9 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 174.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.445 ' HB1' ' HE2' ' A' ' 124' ' ' MET . . . -65.47 -46.21 80.68 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.508 175.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -61.65 -24.91 67.04 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . 0.624 ' HG2' ' OE1' ' B' ' 90' ' ' GLN . 67.1 mttm -68.79 -31.42 70.42 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.163 0.506 . . . . 0.0 110.549 175.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . 0.561 ' O ' ' HB3' ' B' ' 91' ' ' LYS . 74.8 m80 -84.07 -29.7 26.62 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.555 177.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -86.4 -63.15 1.36 Allowed 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -177.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 64.7 mt -81.57 -58.39 3.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 O-C-N 122.198 -0.314 . . . . 0.0 111.085 -173.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . 0.624 ' OE1' ' HG2' ' B' ' 86' ' ' LYS . 46.3 mt-30 -59.1 -36.06 74.5 Favored 'General case' 0 C--O 1.202 -1.421 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.163 -178.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.561 ' HB3' ' O ' ' B' ' 87' ' ' HIS . 20.3 tptp -80.67 -33.31 35.61 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.13 -46.44 77.51 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.571 0.7 . . . . 0.0 110.744 179.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.2 mmmt -91.53 9.61 31.34 Favored 'General case' 0 C--O 1.196 -1.727 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.937 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.458 ' HB2' ' HA ' ' B' ' 91' ' ' LYS . 8.5 t-80 -75.37 -13.31 60.4 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -173.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.541 ' HG3' ' O ' ' A' ' 35' ' ' VAL . 19.4 tpp -134.25 -42.92 0.03 OUTLIER Pre-proline 0 C--N 1.293 -1.854 0 C-N-CA 119.316 -0.953 . . . . 0.0 112.975 -170.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.424 ' CD ' ' H ' ' B' ' 95' ' ' MET . 6.4 Cg_exo -79.31 7.6 4.35 Favored 'Trans proline' 0 C--N 1.379 2.177 0 C-N-CA 121.411 1.407 . . . . 0.0 111.417 175.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -160.26 146.68 11.9 Favored Pre-proline 0 C--N 1.31 -1.136 0 N-CA-C 104.725 -2.324 . . . . 0.0 104.725 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -75.04 89.98 1.12 Allowed 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 121.013 1.142 . . . . 0.0 113.213 176.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . 0.442 ' NE1' ' HG2' ' B' ' 90' ' ' GLN . 3.1 t90 -132.18 137.04 47.47 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 176.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . 0.546 ' HB1' ' HB3' ' A' ' 15' ' ' ALA . . . . . . . . 0 C--N 1.301 -1.507 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.45 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.312 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -119.88 -17.96 8.36 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.053 0.454 . . . . 0.0 110.049 176.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -112.7 159.12 19.24 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 177.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 4' ' ' LEU . 11.1 tp -131.82 147.78 52.51 Favored 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.863 -175.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.9 p -74.68 142.84 44.44 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -67.25 -30.25 70.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -171.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -63.43 -40.09 96.24 Favored 'General case' 0 C--O 1.245 0.859 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 177.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.443 ' HG3' ' CE2' ' A' ' 12' ' ' PHE . 6.6 tp-100 -72.95 -36.32 67.15 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.376 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.47 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 64.7 mt -61.64 -37.84 78.88 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.945 176.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.1 -43.12 99.36 Favored 'General case' 0 C--O 1.256 1.408 0 CA-C-O 121.646 0.736 . . . . 0.0 110.371 176.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -60.62 -41.24 94.46 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.611 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.453 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 21.3 m-85 -74.96 -12.0 60.24 Favored 'General case' 0 C--O 1.189 -2.125 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 177.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 67.7 mttm -69.58 -48.81 58.92 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 173.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.72 -39.91 88.18 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 119.699 -0.8 . . . . 0.0 110.084 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.453 ' HB3' ' HA ' ' A' ' 12' ' ' PHE . . . -69.56 -24.14 63.66 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.409 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.578 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 70.1 t80 -68.52 -52.34 33.12 Favored 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 176.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.8 m -69.55 -16.69 63.47 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.15 -178.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.405 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 41.5 tp -62.78 -31.86 72.91 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 173.084 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.536 ' CD2' HG21 ' A' ' 35' ' ' VAL . 8.8 m-85 -98.29 -43.13 7.08 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.771 177.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -79.43 87.44 5.06 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 122.143 0.973 . . . . 0.0 109.222 176.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 27.5 mmmt -71.27 -26.22 62.8 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 114.046 -1.434 . . . . 0.0 112.358 -172.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.605 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 1.5 m-20 -90.98 -13.17 33.88 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.754 -177.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.46 58.41 9.46 Favored Glycine 0 C--O 1.223 -0.564 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.404 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.605 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 10.3 m-20 -112.12 -16.74 12.97 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -176.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.31 11.4 58.48 Favored Glycine 0 C--N 1.313 -0.722 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 -173.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.414 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 11.2 p -144.7 136.83 26.09 Favored 'General case' 0 N--CA 1.441 -0.925 0 C-N-CA 123.369 0.668 . . . . 0.0 110.167 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 56.9 mt -104.87 127.92 59.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.3 p -103.18 172.91 6.55 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.922 177.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.3 p -64.34 -27.98 69.4 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.881 0.372 . . . . 0.0 111.182 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -53.18 -54.01 42.12 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 124.553 1.141 . . . . 0.0 109.392 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.526 ' HB3' ' O ' ' A' ' 19' ' ' PHE . 35.1 mt-10 -71.2 -38.81 72.05 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 113.719 -1.582 . . . . 0.0 111.271 -174.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -59.32 -49.39 78.0 Favored 'General case' 0 C--O 1.208 -1.112 0 O-C-N 123.447 0.467 . . . . 0.0 110.907 176.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.13 -27.67 72.61 Favored Glycine 0 C--O 1.222 -0.613 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.465 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.2 m -65.7 -50.08 66.18 Favored 'General case' 0 C--O 1.262 1.739 0 CA-C-O 121.693 0.759 . . . . 0.0 109.591 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.697 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 34.8 m -73.35 -41.08 57.3 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.194 -178.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -48.12 75.61 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 123.166 0.587 . . . . 0.0 110.948 177.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -58.26 -39.56 79.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.943 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.8 m -68.63 -27.32 65.91 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 121.328 0.585 . . . . 0.0 111.164 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 52.3 mt -84.1 -20.27 32.87 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.324 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.22 19.02 40.43 Favored Glycine 0 N--CA 1.447 -0.592 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.4 ' C ' ' HD3' ' A' ' 43' ' ' PRO . 3.4 tp-100 -106.07 120.56 42.1 Favored 'General case' 0 N--CA 1.428 -1.573 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 -178.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -126.11 69.23 66.34 Favored Pre-proline 0 C--N 1.301 -1.539 0 C-N-CA 118.663 -1.215 . . . . 0.0 112.866 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.4 ' HD3' ' C ' ' A' ' 41' ' ' GLN . 5.7 Cg_exo -77.25 163.12 30.63 Favored 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 122.293 1.995 . . . . 0.0 109.875 175.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.426 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 22.8 p -75.29 161.77 29.01 Favored 'General case' 0 C--N 1.295 -1.804 0 CA-C-O 120.46 0.172 . . . . 0.0 111.163 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -57.39 -36.1 70.85 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 177.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.17 -49.69 76.13 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.464 178.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 8.1 mm-40 -64.22 -42.59 96.52 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.755 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.34 -45.72 89.92 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.557 0.535 . . . . 0.0 111.48 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.4 tm0? -66.63 -40.12 88.6 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -62.46 -38.06 88.36 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.978 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 21.7 mmt -58.49 -40.07 81.78 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.21 175.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 70.9 mt -67.28 -56.54 13.13 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.15 176.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.49 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.4 t30 -57.34 -26.2 60.61 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 123.488 0.715 . . . . 0.0 112.554 -173.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.57 -46.11 89.83 Favored 'General case' 0 N--CA 1.427 -1.621 0 C-N-CA 123.113 0.565 . . . . 0.0 109.503 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.604 HG11 ' SD ' ' A' ' 71' ' ' MET . 35.3 m -93.71 -19.77 6.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.274 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.49 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 44.8 t0 -67.89 106.84 2.43 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.184 -179.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.55 -9.71 53.65 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.582 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -101.71 -12.56 18.28 Favored 'General case' 0 CA--C 1.497 -1.088 0 C-N-CA 119.263 -0.975 . . . . 0.0 110.284 -173.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 61.23 39.09 96.7 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -172.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -108.14 -2.23 19.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.867 0.365 . . . . 0.0 110.963 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.52 9.14 82.07 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 121.088 -0.577 . . . . 0.0 114.308 172.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.414 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 26.2 p -134.88 150.94 50.52 Favored 'General case' 0 C--O 1.256 1.416 0 CA-C-N 117.5 0.65 . . . . 0.0 111.58 179.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 45.8 mt -91.88 106.64 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 176.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -77.16 163.86 26.19 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.421 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 48.5 t80 -52.01 -53.83 47.47 Favored Pre-proline 0 CA--C 1.561 1.377 0 O-C-N 123.681 0.613 . . . . 0.0 112.33 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -52.44 -38.49 74.16 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.988 2.459 . . . . 0.0 113.341 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -71.2 -43.37 67.53 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 121.243 0.544 . . . . 0.0 110.142 -177.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.578 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 56.5 t80 -62.57 -41.77 99.14 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.455 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 91.4 mt -63.17 -49.49 74.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.749 177.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.7 m -57.75 -46.94 83.8 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.604 ' SD ' HG11 ' A' ' 55' ' ' VAL . 16.6 ptt? -67.72 -32.07 72.45 Favored 'General case' 0 CA--C 1.507 -0.692 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.374 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.1 tpp -71.22 -37.27 72.05 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.73 -30.11 71.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.613 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -75.41 -28.69 59.52 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.019 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 71' ' ' MET . 94.4 mttt -69.85 -29.75 67.07 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.062 -179.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -88.75 94.65 9.98 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 166.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -44.9 -82.96 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.319 1.448 . . . . 0.0 112.948 -172.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -154.47 27.09 0.45 Allowed 'General case' 0 CA--C 1.475 -1.913 0 CA-C-O 124.519 2.104 . . . . 0.0 106.051 176.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.414 ' HB ' ' HB2' ' A' ' 83' ' ' GLU . 1.8 p -150.44 132.51 15.29 Favored 'General case' 1 N--CA 1.369 -4.496 0 CA-C-N 110.925 -2.852 . . . . 0.0 105.55 -177.873 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -128.74 -45.59 1.3 Allowed 'General case' 0 C--N 1.305 -1.35 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.656 178.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.2 m -70.25 -35.88 74.1 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.532 -173.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -101.53 -25.92 13.73 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.182 0.515 . . . . 0.0 111.614 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.414 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 27.2 tp10 -66.53 -46.32 76.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.681 -175.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -59.39 -43.68 92.91 Favored 'General case' 0 CA--C 1.501 -0.928 0 O-C-N 124.119 0.887 . . . . 0.0 110.666 -176.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.658 ' HA ' ' SD ' ' A' ' 145' ' ' MET . 7.0 mm -63.95 -49.64 80.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.574 -1.193 . . . . 0.0 109.302 -174.271 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -69.21 -33.43 73.31 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.969 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -63.74 -53.28 53.52 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.16 -46.01 91.13 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.787 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -60.44 -48.14 83.05 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.096 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.584 ' NE ' ' HA ' ' A' ' 90' ' ' ARG . 0.8 OUTLIER -60.23 -36.66 78.22 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.187 -178.169 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.7 p -75.89 -26.01 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 120.516 -0.474 . . . . 0.0 111.602 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -80.88 -56.32 4.2 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 176.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -88.9 86.15 6.89 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 122.009 0.909 . . . . 0.0 109.201 178.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -78.02 -21.6 50.51 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.249 -174.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.547 ' HB3' ' ND2' ' A' ' 97' ' ' ASN . 13.3 t70 -83.52 -15.13 50.56 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -177.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.509 ' HA2' ' NH2' ' A' ' 90' ' ' ARG . . . 72.06 51.18 14.98 Favored Glycine 0 N--CA 1.44 -1.057 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.804 179.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.547 ' ND2' ' HB3' ' A' ' 95' ' ' ASP . 39.6 m-80 -84.1 -19.61 33.96 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.832 0.348 . . . . 0.0 110.168 -178.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.68 -2.91 86.71 Favored Glycine 0 C--O 1.227 -0.319 0 N-CA-C 110.597 -1.001 . . . . 0.0 110.597 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.432 ' CE1' ' HB2' ' A' ' 137' ' ' ASN . 91.9 m-85 -143.47 150.11 38.51 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.2 mt -111.36 133.16 57.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 177.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.2 m -98.7 156.96 16.57 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.69 -49.48 62.52 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -173.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.26 -33.75 76.73 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 36.3 tt0 -64.96 -46.97 79.33 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.469 176.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.471 HD21 ' SD ' ' A' ' 124' ' ' MET . 9.1 tt -65.31 -36.51 84.29 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.573 ' HA ' HG11 ' A' ' 121' ' ' VAL . 26.1 ttp180 -62.38 -38.44 89.6 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 104' ' ' GLU . 44.0 m170 -61.62 -54.2 46.02 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.067 176.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 6.3 p -61.98 -36.36 73.59 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.55 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.659 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 22.3 mmt -64.28 -41.41 96.92 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-O 121.011 0.434 . . . . 0.0 111.08 178.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.2 m -66.07 -33.88 76.79 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 178.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -75.1 -25.17 58.31 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.539 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.4 mt -87.93 -20.36 26.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.333 0.587 . . . . 0.0 110.721 -178.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.39 -14.06 43.29 Favored Glycine 0 C--N 1.305 -1.149 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.898 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.426 ' OE2' ' HG2' ' B' ' 91' ' ' LYS . 1.1 mp0 -61.85 -42.57 99.21 Favored 'General case' 0 CA--C 1.504 -0.825 0 C-N-CA 123.043 0.537 . . . . 0.0 110.053 177.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 54.5 35.83 24.28 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.454 1.096 . . . . 0.0 111.314 176.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 81.5 mt -57.95 143.31 43.41 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.246 -177.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 16.7 p -70.21 168.39 15.86 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 123.599 0.562 . . . . 0.0 110.539 178.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.52 ' HA ' HG22 ' A' ' 121' ' ' VAL . 11.4 t70 -62.81 -35.39 79.76 Favored 'General case' 0 C--O 1.215 -0.735 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -177.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -53.33 -54.58 34.44 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.546 1.138 . . . . 0.0 111.024 176.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -71.69 -38.37 70.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.118 -175.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.573 HG11 ' HA ' ' A' ' 106' ' ' ARG . 11.9 m -70.95 -33.94 53.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.891 -178.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -71.97 -36.36 69.79 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -60.96 -46.37 90.99 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 175.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.471 ' SD ' HD21 ' A' ' 105' ' ' LEU . 35.5 mtt -53.53 -50.45 65.45 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.735 175.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 121' ' ' VAL . 47.3 mm -63.2 -57.2 12.99 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.506 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.557 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -54.95 -42.23 72.07 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -171.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.513 ' HB2' ' CE1' ' B' ' 81' ' ' PHE . 21.3 mm-40 -74.67 -30.77 61.7 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.412 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -84.0 -27.28 28.53 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.339 0.59 . . . . 0.0 110.502 -179.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.442 ' OD1' ' HA2' ' A' ' 132' ' ' GLY . 7.7 t70 -67.66 96.17 0.53 Allowed 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 125.626 1.57 . . . . 0.0 109.419 175.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.1 mt -82.68 -48.49 17.88 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.836 -176.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.86 -11.3 60.88 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 121.137 0.494 . . . . 0.0 112.245 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.442 ' HA2' ' OD1' ' A' ' 129' ' ' ASP . . . 72.9 47.06 26.78 Favored Glycine 0 C--N 1.306 -1.105 0 N-CA-C 110.814 -0.914 . . . . 0.0 110.814 178.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -98.73 -16.41 18.98 Favored 'General case' 0 C--N 1.306 -1.309 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -178.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.1 10.39 61.15 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -178.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -147.77 134.17 19.64 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 124.729 1.212 . . . . 0.0 107.92 -176.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.405 ' O ' ' HA ' ' A' ' 99' ' ' TYR . 0.7 OUTLIER -88.02 121.56 38.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 CA-C-O 120.564 0.221 . . . . 0.0 111.392 -179.491 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.432 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 20.5 t30 -85.77 154.47 21.58 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.304 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.543 ' O ' HG13 ' A' ' 142' ' ' VAL . 42.1 t80 -56.01 -47.55 77.57 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 124.336 1.054 . . . . 0.0 110.407 178.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.55 -21.62 66.74 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.696 -178.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.426 ' HG3' ' HB3' ' A' ' 137' ' ' ASN . 43.5 mt-10 -87.97 -42.9 12.15 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 122.027 0.917 . . . . 0.0 108.734 177.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -65.9 -28.26 68.81 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 114.637 -1.165 . . . . 0.0 112.1 -177.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.565 ' HA ' HG21 ' A' ' 85' ' ' ILE . 34.6 m -60.34 -29.15 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-O 121.085 0.469 . . . . 0.0 111.638 177.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -79.93 -44.97 19.38 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-O 121.578 0.704 . . . . 0.0 109.586 178.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.412 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 90.9 mmm -66.6 -44.22 82.69 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 114.866 -1.061 . . . . 0.0 112.653 -176.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.658 ' SD ' ' HA ' ' A' ' 85' ' ' ILE . 28.3 ttt -66.02 -33.77 76.56 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -177.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 9.2 t -86.53 0.27 54.66 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.252 0.549 . . . . 0.0 110.696 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -82.74 93.39 7.4 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt . . . . . 0 C--N 1.307 -1.255 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 -178.555 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 30.0 m . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -63.18 -60.21 0.18 Allowed 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.056 1.837 . . . . 0.0 112.03 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -126.03 -50.22 1.57 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 54.27 93.39 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.206 1.402 . . . . 0.0 110.803 -178.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 50.1 m -74.81 24.34 0.09 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -176.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 68.65 -64.53 0.31 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.339 1.455 . . . . 0.0 114.099 176.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -68.0 -21.53 65.04 Favored 'General case' 0 C--O 1.208 -1.096 0 C-N-CA 120.308 -0.557 . . . . 0.0 109.802 -178.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . 0.513 ' CE1' ' HB2' ' A' ' 127' ' ' GLU . 40.5 t80 -49.82 -43.5 48.78 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 124.931 1.292 . . . . 0.0 110.549 172.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -70.73 -47.15 61.23 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -176.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -60.99 -40.52 93.8 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.598 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.61 -49.75 69.86 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.801 -179.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.402 ' O ' HG12 ' B' ' 89' ' ' ILE . 64.8 m95 -59.71 -39.74 85.63 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.92 177.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -53.63 -59.78 4.16 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 122.004 0.907 . . . . 0.0 109.262 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -62.37 -38.0 87.87 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.158 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.08 -51.8 66.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.448 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.402 HG12 ' O ' ' B' ' 85' ' ' TRP . 26.9 pt -66.12 -34.24 68.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.736 -0.386 . . . . 0.0 111.789 -177.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -59.33 -43.89 92.67 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.139 0.495 . . . . 0.0 110.285 175.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.426 ' HG2' ' OE2' ' A' ' 114' ' ' GLU . 5.6 tppp? -75.02 -45.44 41.74 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.312 -178.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.13 -41.62 97.14 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -174.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -64.52 -34.01 77.24 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.282 0.563 . . . . 0.0 110.389 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.423 ' HD2' ' O ' ' B' ' 95' ' ' MET . 7.2 t60 -66.97 137.02 56.21 Favored 'General case' 0 CA--C 1.56 1.364 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.176 -176.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.518 ' HB3' ' CD ' ' B' ' 96' ' ' PRO . 64.5 mtt -114.75 -157.51 0.03 OUTLIER Pre-proline 0 CA--C 1.573 1.861 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.518 ' CD ' ' HB3' ' B' ' 95' ' ' MET . 17.2 Cg_exo -74.67 19.27 0.47 Allowed 'Trans proline' 0 C--N 1.372 1.78 0 CA-C-N 123.487 2.281 . . . . 0.0 112.11 172.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . 0.436 ' H ' ' C ' ' B' ' 95' ' ' MET . 8.5 p-10 -104.09 169.38 7.34 Favored Pre-proline 0 C--N 1.308 -1.217 0 C-N-CA 125.067 1.347 . . . . 0.0 109.577 -175.042 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -85.97 93.62 0.6 Allowed 'Trans proline' 0 N--CA 1.435 -1.96 0 C-N-CA 122.347 2.032 . . . . 0.0 109.2 171.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 2.5 t90 -117.76 130.62 56.41 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 107.243 -1.392 . . . . 0.0 107.243 -175.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . 0.44 ' HB2' ' CZ ' ' A' ' 68' ' ' PHE . . . . . . . . 0 C--N 1.288 -2.092 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.384 0 CA-C-O 120.195 0.045 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -129.74 98.1 4.71 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.491 ' H ' ' HB1' ' A' ' 73' ' ' ALA . 28.0 mt-30 -135.44 85.91 2.2 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 173.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.497 HD23 HG12 ' A' ' 9' ' ' ILE . 6.0 tp -132.96 126.83 32.88 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 -177.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 16.7 p -74.64 154.18 38.62 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.515 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.7 mp0 -53.33 -45.23 68.99 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.546 0.738 . . . . 0.0 111.331 -175.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -66.3 -34.32 77.73 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.059 0.457 . . . . 0.0 110.685 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 8.8 tp-100 -72.23 -36.17 69.05 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.497 HG12 HD23 ' A' ' 4' ' ' LEU . 62.7 mt -66.64 -34.59 71.07 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.852 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.667 175.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.61 98.91 Favored 'General case' 0 C--O 1.267 2.016 0 C-N-CA 123.128 0.571 . . . . 0.0 110.587 174.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 8' ' ' GLN . 42.6 mm-40 -55.64 -49.06 73.87 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 174.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -68.63 -25.9 65.07 Favored 'General case' 0 C--O 1.187 -2.224 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.311 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 9' ' ' ILE . 32.9 mmtp -56.48 -56.89 15.59 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 175.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -71.15 -40.77 71.16 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.786 -177.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.424 ' HB1' ' HB1' ' B' ' 100' ' ' ALA . . . -65.13 -30.96 71.93 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.323 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -68.08 -44.48 76.19 Favored 'General case' 0 C--O 1.204 -1.315 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.6 m -63.35 -25.68 68.41 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 120.969 0.414 . . . . 0.0 111.509 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -67.17 -36.99 82.98 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.479 ' CD2' HG21 ' A' ' 35' ' ' VAL . 26.0 m-85 -88.17 -38.41 15.34 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.573 -179.048 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -78.2 99.39 6.21 Favored 'General case' 0 CA--C 1.501 -0.926 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 176.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -77.93 -5.23 50.42 Favored 'General case' 0 C--N 1.287 -2.143 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.069 -173.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.639 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 4.1 m-20 -116.98 -13.72 10.63 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.51 53.98 25.49 Favored Glycine 0 CA--C 1.524 0.618 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.881 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.639 ' OD1' ' HB2' ' A' ' 22' ' ' ASP . 3.6 m-20 -110.66 -17.79 13.31 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 117.233 0.516 . . . . 0.0 110.241 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.38 21.08 39.09 Favored Glycine 0 N--CA 1.439 -1.165 0 N-CA-C 109.299 -1.521 . . . . 0.0 109.299 -173.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.3 p -146.7 130.98 17.49 Favored 'General case' 0 C--O 1.252 1.229 0 C-N-CA 123.87 0.868 . . . . 0.0 109.613 -178.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 75.1 mt -113.35 121.46 65.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.54 ' OG1' ' HB3' ' A' ' 30' ' ' LYS . 17.9 p -93.83 175.51 6.7 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.282 178.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.3 p -66.78 -26.58 67.03 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-O 121.316 0.579 . . . . 0.0 109.687 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.54 ' HB3' ' OG1' ' A' ' 28' ' ' THR . 35.4 tttm -49.56 -59.31 3.89 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.401 1.48 . . . . 0.0 109.107 171.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -71.61 -35.77 70.58 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.387 -174.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.5 mt -58.21 -52.04 67.23 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.58 0.55 . . . . 0.0 109.753 175.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.85 -30.13 76.52 Favored Glycine 0 C--O 1.216 -1.0 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.243 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.4 m -59.74 -53.37 58.75 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-O 120.897 0.38 . . . . 0.0 110.624 177.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.482 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 34.2 m -70.28 -34.32 58.02 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.369 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.93 -178.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.472 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 49.6 mtt -68.92 -34.94 76.2 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.969 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.0 ttp85 -60.31 -41.9 94.43 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -64.79 -32.3 73.93 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.741 176.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 90.4 mt -84.36 -5.43 59.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.422 -178.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.15 25.46 37.04 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 116.391 -0.368 . . . . 0.0 113.508 178.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.404 ' C ' HD22 ' A' ' 42' ' ' ASN . 9.4 tt0 -125.59 133.94 52.1 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.404 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -120.65 83.65 35.61 Favored Pre-proline 0 C--N 1.301 -1.507 0 O-C-N 122.226 -0.297 . . . . 0.0 110.513 176.839 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.472 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 6.1 Cg_exo -82.64 154.34 15.62 Favored 'Trans proline' 0 C--O 1.24 0.616 0 C-N-CA 123.121 2.547 . . . . 0.0 111.251 176.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.9 p -86.19 161.74 18.68 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -46.92 -58.96 3.42 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.894 1.678 . . . . 0.0 112.361 -175.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.49 -29.86 70.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -175.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 51' ' ' MET . 8.1 mm-40 -68.94 -45.29 71.14 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.1 mt -62.8 -41.2 99.17 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.616 -1.175 . . . . 0.0 109.323 177.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -56.1 -48.09 76.81 Favored 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 123.504 0.722 . . . . 0.0 111.269 176.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -63.66 -37.44 87.36 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 120.613 0.244 . . . . 0.0 111.016 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.602 ' SD ' ' HD2' ' B' ' 96' ' ' PRO . 28.1 mmt -59.59 -48.1 83.0 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.423 HG22 ' HB2' ' A' ' 56' ' ' ASP . 61.1 mt -61.04 -45.28 98.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.153 177.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -60.3 -14.84 20.36 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 125.108 1.363 . . . . 0.0 114.49 -176.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -69.76 -39.29 76.8 Favored 'General case' 0 N--CA 1.408 -2.534 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 177.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.717 HG11 ' HB2' ' A' ' 71' ' ' MET . 18.7 m -110.49 -15.86 9.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.028 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.742 -174.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.423 ' HB2' HG22 ' A' ' 52' ' ' ILE . 29.9 t0 -71.49 104.91 3.4 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -177.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.41 -26.6 24.65 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.173 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.73 -11.93 38.14 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -176.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 59.63 60.7 8.27 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.787 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -108.03 -17.36 14.06 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.81 23.51 38.63 Favored Glycine 0 N--CA 1.426 -1.986 0 N-CA-C 109.207 -1.557 . . . . 0.0 109.207 -172.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 57.3 p -139.14 136.11 34.77 Favored 'General case' 0 C--O 1.27 2.165 0 C-N-CA 122.593 0.357 . . . . 0.0 110.321 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.422 HG13 HG12 ' A' ' 52' ' ' ILE . 54.6 mt -91.7 104.7 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.127 0 N-CA-C 105.003 -2.221 . . . . 0.0 105.003 174.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -82.49 153.4 25.61 Favored 'General case' 0 C--N 1.285 -2.213 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 -176.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -45.08 -52.73 18.82 Favored Pre-proline 0 N--CA 1.487 1.4 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -176.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -49.54 -42.64 41.72 Favored 'Trans proline' 0 C--N 1.367 1.537 0 C-N-CA 122.842 2.361 . . . . 0.0 112.65 175.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -73.47 -34.09 65.19 Favored 'General case' 0 CA--C 1.508 -0.664 0 C-N-CA 122.884 0.473 . . . . 0.0 110.304 -178.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -62.8 -39.5 94.46 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.5 mt -64.14 -47.47 79.83 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.858 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.4 m -57.64 -41.52 81.55 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.418 0.687 . . . . 0.0 110.281 178.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.717 ' HB2' HG11 ' A' ' 55' ' ' VAL . 31.5 ttp -57.58 -45.01 85.78 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.204 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 26.3 mmt -77.42 -38.88 48.72 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.508 -177.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 78' ' ' ASP . . . -59.44 -46.48 88.62 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 123.35 0.407 . . . . 0.0 111.137 179.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 66.2 mtp180 -56.42 -31.64 64.1 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.602 0.715 . . . . 0.0 111.758 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -88.13 -25.81 22.8 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.459 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.2 ttp -126.59 109.44 12.12 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.699 -175.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? 77.08 -51.04 0.56 Allowed 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 114.382 1.252 . . . . 0.0 114.382 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.526 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 11.1 t70 -77.98 156.47 30.16 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 178.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 41.4 m 61.81 60.97 1.48 Allowed 'General case' 0 CA--C 1.553 1.079 0 CA-C-O 122.603 1.192 . . . . 0.0 109.794 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -94.02 22.85 5.38 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.996 0.903 . . . . 0.0 109.729 -179.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 p -75.2 13.27 0.74 Allowed 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 125.111 1.365 . . . . 0.0 111.806 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 73.47 -1.71 2.97 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 126.274 1.829 . . . . 0.0 111.953 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.1 -46.23 90.3 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -175.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -67.52 -35.9 79.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.036 0.446 . . . . 0.0 110.882 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 18.9 mm -73.3 -41.68 57.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-O 121.952 0.882 . . . . 0.0 109.217 -176.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -74.25 -34.09 63.5 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.831 -178.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.17 -46.89 88.65 Favored 'General case' 0 CA--C 1.501 -0.905 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.446 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -56.37 -45.77 80.37 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 113.911 -1.495 . . . . 0.0 110.943 177.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -67.21 -45.84 75.64 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 119.739 -0.784 . . . . 0.0 110.863 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -67.07 -22.56 65.84 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -177.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 88' ' ' ALA . 8.1 p -78.88 -21.65 12.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 C-N-CA 119.771 -0.771 . . . . 0.0 110.067 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -94.47 -39.24 10.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.48 175.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -109.27 92.65 4.13 Favored 'General case' 0 C--O 1.245 0.823 0 CA-C-O 121.8 0.81 . . . . 0.0 109.589 174.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -51.47 9.73 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 114.06 -1.427 . . . . 0.0 111.899 -174.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -85.4 -12.37 52.24 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -171.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.23 55.12 1.75 Allowed Glycine 0 N--CA 1.432 -1.612 0 C-N-CA 119.771 -1.204 . . . . 0.0 110.997 177.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -83.21 -18.38 39.5 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.58 -15.54 40.71 Favored Glycine 0 CA--C 1.501 -0.803 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.595 175.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.622 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 73.0 m-85 -140.04 134.4 31.34 Favored 'General case' 0 N--CA 1.417 -2.079 0 N-CA-C 107.275 -1.379 . . . . 0.0 107.275 -179.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.417 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.0 mt -75.27 135.52 27.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.713 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 177.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 6.5 m -105.97 139.58 40.29 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -177.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.55 -47.7 80.52 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.613 0.598 . . . . 0.0 112.613 -175.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.6 -43.14 97.77 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.675 -178.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -66.09 -40.86 91.14 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.099 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.511 ' O ' ' HG2' ' A' ' 109' ' ' MET . 7.0 tt -62.59 -39.28 93.22 Favored 'General case' 0 C--O 1.215 -0.75 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.441 ' HG3' HG11 ' A' ' 121' ' ' VAL . 27.8 ttt180 -68.34 -30.37 69.31 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.305 0.574 . . . . 0.0 109.943 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -69.88 -45.04 68.55 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.736 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.585 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.7 p -64.59 -29.23 46.78 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.471 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.511 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 19.3 mmt -59.53 -49.61 77.13 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 177.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 23.0 m -60.09 -34.77 73.92 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 121.001 0.429 . . . . 0.0 110.061 177.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -70.77 -33.49 70.83 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.087 0.555 . . . . 0.0 110.906 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 72.6 mt -81.4 -8.17 59.69 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.335 0.588 . . . . 0.0 110.565 -178.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 95.36 19.45 30.2 Favored Glycine 0 N--CA 1.432 -1.612 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.996 179.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -98.55 177.02 5.46 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -151.28 48.07 0.83 Allowed 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.928 0.871 . . . . 0.0 109.162 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.413 HD12 ' HG3' ' A' ' 109' ' ' MET . 82.2 mt -76.16 143.99 40.83 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.186 -176.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 44.4 p -78.0 170.61 16.31 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.256 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.459 ' HA ' HG22 ' A' ' 121' ' ' VAL . 3.7 p-10 -70.17 -20.65 63.12 Favored 'General case' 0 C--O 1.206 -1.234 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.907 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -71.39 -45.05 63.78 Favored 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 123.485 0.491 . . . . 0.0 110.28 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -65.24 -45.3 85.18 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.964 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.459 HG22 ' HA ' ' A' ' 118' ' ' ASP . 12.8 m -72.57 -27.89 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.39 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.62 -46.29 79.84 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.664 174.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -64.1 -34.19 77.48 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.556 -177.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 65.2 mtt -57.7 -57.72 11.51 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.179 175.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.5 mm -61.56 -56.43 17.84 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.186 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.857 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 -53.01 -44.06 67.0 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 124.909 1.283 . . . . 0.0 113.285 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.645 ' HB2' ' CE1' ' B' ' 81' ' ' PHE . 59.2 mm-40 -87.06 -7.77 57.75 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.957 -175.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -95.43 -30.79 13.7 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 173.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -66.21 102.37 0.83 Allowed 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 125.772 1.629 . . . . 0.0 109.013 173.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.4 mt -81.76 -44.65 20.25 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.766 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.941 -174.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -73.73 -11.58 60.44 Favored 'General case' 0 C--O 1.243 0.717 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.43 44.72 20.87 Favored Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 120.51 -0.853 . . . . 0.0 111.252 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -98.03 -16.18 19.73 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.106 0.479 . . . . 0.0 110.126 -177.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.52 4.27 64.13 Favored Glycine 0 C--O 1.241 0.571 0 C-N-CA 120.463 -0.875 . . . . 0.0 111.107 -177.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.622 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 41.7 mt-30 -137.73 151.61 48.38 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.417 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.3 p -114.7 116.33 52.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 C-N-CA 119.898 -0.721 . . . . 0.0 112.893 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.431 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 27.9 t30 -75.55 157.57 33.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.311 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -50.52 -49.04 56.78 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.359 1.064 . . . . 0.0 110.726 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -64.02 -24.73 67.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.985 -177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -85.1 -42.21 15.01 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -63.25 -44.62 94.65 Favored 'General case' 0 N--CA 1.439 -0.995 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.431 178.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 33.7 m -63.92 -30.19 49.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.68 0.276 . . . . 0.0 111.735 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -71.15 -44.06 66.31 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 121.614 0.721 . . . . 0.0 109.935 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 12.9 tmm? -75.41 -40.0 58.35 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.342 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 26.8 ttt -68.25 -26.65 65.79 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -178.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 16.3 p -80.71 -17.08 52.21 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.245 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -101.83 100.21 10.51 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 97.3 mttt . . . . . 0 C--O 1.25 1.098 0 C-N-CA 125.359 1.464 . . . . 0.0 111.675 -178.395 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.436 -1.167 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -73.92 37.11 0.42 Allowed 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 123.698 2.932 . . . . 0.0 112.64 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -131.97 31.16 4.21 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.466 -175.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -94.31 -44.31 8.0 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 174.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 49.9 m -105.19 -10.87 16.83 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.284 174.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 60.33 29.53 19.08 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.4 1.08 . . . . 0.0 111.316 175.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -141.39 15.23 2.2 Favored 'General case' 0 C--O 1.208 -1.109 0 C-N-CA 118.785 -1.166 . . . . 0.0 111.466 -173.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . 0.645 ' CE1' ' HB2' ' A' ' 127' ' ' GLU . 49.6 t80 -48.93 -58.59 4.62 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 115.429 1.64 . . . . 0.0 115.429 -175.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . 0.407 ' HD3' ' HA ' ' B' ' 82' ' ' LYS . 56.3 mmtt -75.1 -36.78 61.67 Favored 'General case' 0 CA--C 1.496 -1.127 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -175.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.76 -31.41 72.37 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 123.703 0.627 . . . . 0.0 109.346 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -68.79 -56.11 9.06 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.592 177.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 49.3 m95 -59.43 -42.05 90.97 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . 0.461 ' HA ' ' HE3' ' B' ' 86' ' ' LYS . 0.7 OUTLIER -52.43 -60.48 3.18 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.339 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -56.13 -47.7 77.65 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.506 -1.679 . . . . 0.0 111.159 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.66 -59.67 4.58 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 123.421 0.688 . . . . 0.0 112.81 -176.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 86.9 mt -54.51 -51.27 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 O-C-N 123.793 0.683 . . . . 0.0 111.839 -174.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . 0.415 ' OE1' ' HE2' ' B' ' 86' ' ' LYS . 49.1 mt-30 -62.66 -44.27 96.69 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.096 -174.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.526 ' HA ' ' O ' ' B' ' 94' ' ' HIS 0.296 19.4 ptmt -81.62 -19.67 41.33 Favored 'General case' 0 C--O 1.21 -0.998 0 C-N-CA 119.256 -0.978 . . . . 0.0 113.447 179.627 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.37 -38.45 81.41 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.453 -0.779 . . . . 0.0 109.216 173.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -74.18 -32.67 63.18 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.601 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.526 ' O ' ' HA ' ' B' ' 91' ' ' LYS . 58.1 m170 -140.05 103.04 4.53 Favored 'General case' 0 CA--C 1.499 -1.019 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 174.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.549 ' HB2' ' HD3' ' B' ' 96' ' ' PRO . 1.5 mpt? -53.29 -50.78 80.67 Favored Pre-proline 0 N--CA 1.473 0.701 0 O-C-N 123.39 0.431 . . . . 0.0 110.885 -178.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.602 ' HD2' ' SD ' ' A' ' 51' ' ' MET . 11.4 Cg_endo -99.29 95.06 0.05 OUTLIER 'Trans proline' 0 N--CA 1.425 -2.513 0 C-N-CA 122.175 1.917 . . . . 0.0 110.057 169.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -110.38 132.27 21.6 Favored Pre-proline 0 C--N 1.307 -1.272 0 C-N-CA 120.511 -0.475 . . . . 0.0 111.506 -176.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.44 64.09 8.49 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.013 2.476 . . . . 0.0 110.667 174.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -72.02 88.79 1.09 Allowed 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.749 -176.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . 0.424 ' HB1' ' HB1' ' A' ' 15' ' ' ALA . . . . . . . . 0 C--N 1.311 -1.099 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.618 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.384 0 CA-C-O 120.812 0.339 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.445 ' OD1' ' HA ' ' A' ' 70' ' ' THR . 25.0 m-20 -86.34 111.02 20.08 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-O 121.141 0.496 . . . . 0.0 109.769 -175.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -87.57 77.28 8.79 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.566 HD23 HG12 ' A' ' 9' ' ' ILE . 14.2 tp -118.85 142.49 47.68 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -176.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.606 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 38.2 p -72.67 142.9 48.26 Favored 'General case' 0 N--CA 1.427 -1.6 0 C-N-CA 119.223 -0.991 . . . . 0.0 108.864 176.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -71.58 -18.05 62.26 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 112.98 0.734 . . . . 0.0 112.98 -172.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -71.05 -36.52 72.34 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.606 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 6.8 mm100 -70.11 -39.89 75.22 Favored 'General case' 0 C--O 1.196 -1.743 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 177.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.566 HG12 HD23 ' A' ' 4' ' ' LEU . 32.0 mt -59.93 -39.11 79.19 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.039 176.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.88 -47.26 85.8 Favored 'General case' 0 C--O 1.246 0.914 0 C-N-CA 123.308 0.643 . . . . 0.0 111.064 176.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.428 ' OE1' ' HB3' ' A' ' 148' ' ' LYS . 32.3 tt0 -63.46 -42.09 98.61 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.801 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.56 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 14.9 m-30 -65.37 -34.72 78.97 Favored 'General case' 0 C--O 1.187 -2.212 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.085 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 97.3 mttt -57.03 -43.45 81.89 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.245 0.341 . . . . 0.0 110.89 174.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -59.68 -61.15 2.83 Favored 'General case' 0 C--O 1.258 1.509 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.576 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.64 -26.56 67.86 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.797 -177.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.56 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 30.9 t80 -61.37 -47.6 85.11 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 123.332 0.653 . . . . 0.0 110.503 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.1 m -75.28 -16.93 60.4 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.164 0.507 . . . . 0.0 110.977 178.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.34 -36.64 79.56 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 172.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -84.25 -41.79 16.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.025 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -80.74 99.14 8.07 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -73.6 -1.68 19.8 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 115.378 1.622 . . . . 0.0 115.378 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -116.75 -14.38 10.77 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 117.996 -1.482 . . . . 0.0 112.014 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.53 28.34 33.02 Favored Glycine 0 C--N 1.309 -0.929 0 C-N-CA 120.28 -0.962 . . . . 0.0 112.637 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -101.2 -17.44 16.62 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.197 0.523 . . . . 0.0 109.788 178.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.58 20.45 76.64 Favored Glycine 0 N--CA 1.437 -1.262 0 CA-C-N 115.537 -0.756 . . . . 0.0 114.733 176.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.6 p -132.04 128.69 38.82 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 171.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.7 mt -104.31 115.75 46.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.846 0 O-C-N 121.873 -0.517 . . . . 0.0 109.731 -174.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -83.61 173.35 11.48 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.043 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 39.1 p -61.87 -43.05 99.64 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 120.864 0.364 . . . . 0.0 111.022 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -64.91 -35.08 79.99 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.656 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.77 -45.35 68.23 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.083 177.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.9 mt -54.59 -55.72 26.47 Favored 'General case' 0 C--O 1.201 -1.477 0 O-C-N 124.133 0.895 . . . . 0.0 110.723 177.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.25 -31.69 77.96 Favored Glycine 0 CA--C 1.522 0.508 0 C-N-CA 120.66 -0.781 . . . . 0.0 113.486 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.3 m -70.95 -48.77 51.62 Favored 'General case' 0 C--O 1.247 0.972 0 CA-C-N 117.285 0.542 . . . . 0.0 110.686 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.4 m -68.39 -35.11 69.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.637 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.238 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.422 ' HB3' ' HB3' ' A' ' 41' ' ' GLN . 64.5 mtt -65.82 -33.03 74.92 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.149 177.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -62.67 -41.94 99.35 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -68.23 -20.43 64.82 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.706 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.457 ' C ' ' HD2' ' B' ' 91' ' ' LYS . 4.3 mm? -101.0 13.85 33.87 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.048 0.452 . . . . 0.0 112.152 177.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.97 26.98 61.15 Favored Glycine 0 C--O 1.241 0.575 0 N-CA-C 114.564 0.586 . . . . 0.0 114.564 173.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.422 ' HB3' ' HB3' ' A' ' 36' ' ' MET . 10.4 tt0 -127.07 124.41 39.19 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -179.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -119.27 78.01 18.22 Favored Pre-proline 0 C--N 1.298 -1.639 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.475 ' HG2' HD21 ' A' ' 48' ' ' LEU . 38.9 Cg_endo -89.31 160.09 5.59 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 122.29 1.993 . . . . 0.0 112.1 -179.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 39.6 p -80.85 159.98 24.9 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.68 -26.59 68.45 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 120.687 0.28 . . . . 0.0 110.656 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.68 -46.92 85.95 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.105 0.479 . . . . 0.0 110.037 175.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -66.6 -35.02 79.18 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.331 178.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.475 HD21 ' HG2' ' A' ' 43' ' ' PRO . 97.1 mt -66.01 -49.87 66.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.983 177.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -58.43 -43.68 88.81 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 122.959 0.503 . . . . 0.0 110.789 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -65.32 -40.77 94.14 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.083 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.8 tpt -62.27 -42.34 99.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.426 0.631 . . . . 0.0 109.582 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 48' ' ' LEU . 79.5 mt -62.21 -48.98 85.88 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.922 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.913 177.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -52.5 -37.09 56.63 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -174.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -66.43 -28.33 68.52 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.09 -1.044 . . . . 0.0 111.637 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.587 HG11 ' HB2' ' A' ' 71' ' ' MET . 7.8 m -101.58 -20.84 5.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.565 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.407 ' HB2' HG22 ' A' ' 52' ' ' ILE . 31.8 t0 -72.59 111.81 8.09 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 123.904 0.882 . . . . 0.0 111.182 -174.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.87 -16.05 37.22 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.604 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -98.19 -12.42 21.71 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 -177.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 57.11 31.91 62.42 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -173.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.3 p-10 -98.31 -5.42 32.97 Favored 'General case' 0 CA--C 1.511 -0.533 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -172.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.58 23.55 39.2 Favored Glycine 0 N--CA 1.44 -1.05 0 C-N-CA 120.087 -1.054 . . . . 0.0 112.458 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.24 139.95 30.46 Favored 'General case' 0 C--O 1.253 1.279 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 178.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 65.2 mt -92.66 111.75 24.95 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -85.41 166.11 16.66 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.438 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 70.7 t80 -56.17 -53.63 61.47 Favored Pre-proline 0 CA--C 1.554 1.127 0 O-C-N 123.425 0.453 . . . . 0.0 112.114 179.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 9.8 Cg_endo -51.94 -37.35 66.99 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.927 2.418 . . . . 0.0 112.383 175.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -74.55 -33.55 62.75 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.458 0.647 . . . . 0.0 110.3 -177.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -68.21 -36.8 80.1 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 87.3 mt -61.73 -47.04 87.05 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.396 175.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.445 ' HA ' ' OD1' ' A' ' 2' ' ' ASP . 55.8 m -56.24 -47.02 79.33 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 123.764 0.665 . . . . 0.0 110.827 177.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.587 ' HB2' HG11 ' A' ' 55' ' ' VAL . 28.3 ttp -57.58 -42.25 82.76 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 123.205 0.602 . . . . 0.0 111.551 179.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 25.1 mmt -75.28 -44.92 43.11 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.434 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.26 77.48 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.927 0.394 . . . . 0.0 110.227 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -63.87 -46.49 84.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.582 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -62.24 -51.74 66.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.394 -175.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.0 ttm -56.05 -43.32 77.77 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 125.169 1.388 . . . . 0.0 112.528 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 50.3 tttp -89.15 -24.82 22.11 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.895 -174.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -80.77 -58.8 2.93 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-O 121.855 0.836 . . . . 0.0 112.049 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.2 t -101.49 88.71 3.51 Favored 'General case' 0 C--N 1.245 -3.977 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.693 -177.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -117.72 0.41 12.0 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.638 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.9 m -77.89 35.82 0.21 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 123.71 0.804 . . . . 0.0 112.614 -173.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 61.47 16.48 7.58 Favored 'General case' 0 C--O 1.209 -1.063 0 C-N-CA 123.916 0.886 . . . . 0.0 110.937 -177.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -70.25 -56.39 6.89 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 116.891 -0.14 . . . . 0.0 111.053 -172.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -63.61 -28.75 70.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.806 0.813 . . . . 0.0 109.878 178.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.5 mm -70.96 -52.74 25.36 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-N 114.464 -1.243 . . . . 0.0 109.646 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 35.4 ttm180 -71.31 -35.83 71.39 Favored 'General case' 0 C--O 1.204 -1.304 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.13 -176.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -58.26 -37.59 75.24 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 123.257 0.348 . . . . 0.0 111.502 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -70.25 -39.23 75.15 Favored 'General case' 0 C--O 1.211 -0.923 0 O-C-N 123.484 0.49 . . . . 0.0 110.849 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -71.52 -45.39 62.52 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-O 121.457 0.646 . . . . 0.0 109.899 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -64.3 -28.3 69.62 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 125.824 1.65 . . . . 0.0 111.974 -176.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 88' ' ' ALA . 8.4 p -77.81 -22.61 13.9 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.877 -179.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -89.3 -56.81 3.12 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 174.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 97' ' ' ASN . 16.2 t0 -91.4 80.95 5.45 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 122.136 0.97 . . . . 0.0 109.159 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.614 ' HD2' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -78.53 -30.17 46.88 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.51 -1.223 . . . . 0.0 113.572 -175.688 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.8 -13.49 59.38 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.516 0.674 . . . . 0.0 110.612 -178.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.62 76.16 0.8 Allowed Glycine 0 N--CA 1.438 -1.202 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.01 177.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.402 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 35.5 m-80 -110.72 -19.25 12.92 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.199 0.523 . . . . 0.0 109.854 178.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.62 0.98 87.78 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.91 176.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -141.31 145.44 35.48 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -178.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.48 ' HB ' HG13 ' A' ' 136' ' ' VAL . 1.8 mt -105.5 113.54 42.68 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 174.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.6 m -96.46 156.58 16.28 Favored 'General case' 0 C--N 1.292 -1.921 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.88 -39.95 96.04 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 117.748 0.249 . . . . 0.0 111.04 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.51 -44.44 96.01 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 123.399 0.437 . . . . 0.0 110.569 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -65.39 -49.74 68.15 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.277 177.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.462 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.3 tm? -60.79 -40.57 93.14 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 115.305 -0.862 . . . . 0.0 108.746 -174.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.451 ' HB2' HG21 ' A' ' 121' ' ' VAL . 0.7 OUTLIER -59.47 -47.14 86.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 176.25 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -55.49 -52.73 62.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.725 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.708 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.8 p -66.2 -37.63 80.16 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.553 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.358 -177.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.9 mmt -60.69 -41.32 94.94 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.7 m -58.82 -41.31 86.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 175.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -74.49 -24.02 58.95 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.443 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.708 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 84.1 mt -87.61 -19.62 27.53 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.097 0.475 . . . . 0.0 110.098 -178.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 83.19 35.05 19.09 Favored Glycine 0 N--CA 1.43 -1.745 0 C-N-CA 120.892 -0.671 . . . . 0.0 111.543 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -98.83 132.95 43.79 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -84.5 46.22 1.21 Allowed 'General case' 0 C--N 1.292 -1.935 0 C-N-CA 123.473 0.709 . . . . 0.0 110.951 -176.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.419 HD12 ' HG3' ' A' ' 109' ' ' MET . 38.2 mt -86.2 129.52 34.82 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.7 p -79.01 168.44 19.68 Favored 'General case' 0 C--N 1.297 -1.704 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.479 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.51 -50.73 71.54 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -176.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.413 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 1.4 mp0 -60.38 -32.87 71.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.486 0.66 . . . . 0.0 109.719 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -71.52 -43.42 66.49 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.873 -178.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.5 m -68.98 -32.55 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 177.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -67.23 -45.57 76.35 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.529 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -72.06 -32.59 67.22 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.687 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.5 tpp -53.28 -49.22 67.4 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 172.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.0 mm -67.15 -48.33 79.01 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.208 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.531 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -57.67 -33.75 68.67 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.702 0.801 . . . . 0.0 112.259 -175.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 25.6 tp10 -82.76 -23.82 33.78 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.163 0.506 . . . . 0.0 111.189 -178.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -87.98 -24.05 23.65 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.668 0.746 . . . . 0.0 109.522 177.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.482 ' OD2' ' HA2' ' A' ' 132' ' ' GLY . 5.0 t70 -69.96 99.72 1.47 Allowed 'General case' 0 C--N 1.309 -1.152 0 C-N-CA 125.825 1.65 . . . . 0.0 109.763 175.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.6 mt -82.33 -47.76 18.73 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -174.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -73.84 -10.68 59.91 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 121.203 0.525 . . . . 0.0 110.997 -176.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.482 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 72.56 52.21 10.6 Favored Glycine 0 N--CA 1.437 -1.286 0 N-CA-C 110.282 -1.127 . . . . 0.0 110.282 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -106.46 -17.37 14.29 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -177.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 103.64 -9.37 52.3 Favored Glycine 0 N--CA 1.437 -1.251 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.245 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -133.3 137.3 45.92 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 -178.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.48 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.3 p -88.14 116.92 30.87 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 CA-C-O 121.589 0.709 . . . . 0.0 110.469 177.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -84.5 159.58 20.7 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 114.832 -1.077 . . . . 0.0 109.819 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.494 ' O ' HG13 ' A' ' 142' ' ' VAL . 77.0 t80 -54.85 -46.74 74.71 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 123.858 0.863 . . . . 0.0 111.328 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -62.2 -22.34 65.84 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -87.77 -43.3 11.97 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.57 -35.47 81.09 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.941 -178.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 138' ' ' TYR . 32.6 m -58.38 -35.89 56.07 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.924 0 CA-C-O 120.933 0.397 . . . . 0.0 110.908 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -75.43 -21.05 58.48 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.41 -178.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 92.4 mmm -76.98 -35.42 57.2 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 90.6 mmm -73.6 -23.87 59.97 Favored 'General case' 0 N--CA 1.427 -1.619 0 CA-C-N 113.455 -1.702 . . . . 0.0 110.362 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 22.6 m -88.22 -6.45 57.81 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 121.263 0.554 . . . . 0.0 110.346 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -81.57 45.36 0.87 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.373 0.606 . . . . 0.0 111.905 -176.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.499 ' HA ' ' NZ ' ' B' ' 82' ' ' LYS . 7.7 mtpm? . . . . . 0 C--N 1.304 -1.405 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . 0.407 ' HA ' ' HD3' ' B' ' 75' ' ' PRO . 48.1 t . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' B' ' 74' ' ' SER . 15.3 Cg_exo -74.99 -8.31 19.96 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 122.409 2.073 . . . . 0.0 111.045 174.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.6 163.27 14.18 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.376 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -119.56 131.36 55.51 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.5 m -58.11 -39.83 79.65 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 122.486 0.314 . . . . 0.0 110.856 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -73.58 -22.14 60.14 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -76.93 -35.74 57.1 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 178.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -79.67 -23.22 42.63 Favored 'General case' 0 C--O 1.196 -1.713 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.899 174.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . 0.522 ' O ' ' HG3' ' B' ' 86' ' ' LYS . 87.4 tttt -60.63 -33.96 73.54 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 173.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -59.8 -50.93 71.9 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 176.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.46 -41.81 98.62 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 113.468 -1.696 . . . . 0.0 111.303 177.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.401 ' O ' HG12 ' B' ' 89' ' ' ILE . 74.1 m95 -58.02 -36.43 72.69 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 177.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' B' ' 82' ' ' LYS . 89.1 mttt -52.6 -34.88 52.84 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.483 0.658 . . . . 0.0 110.171 177.087 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -85.02 -54.28 4.75 Favored 'General case' 0 C--O 1.205 -1.283 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.891 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.0 -51.63 51.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.904 0.882 . . . . 0.0 112.748 -176.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.44 HD12 ' HB1' ' A' ' 88' ' ' ALA . 50.4 mm -61.32 -53.35 49.9 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.427 0 CA-C-O 121.543 0.687 . . . . 0.0 109.604 -179.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -69.31 -32.43 71.56 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.624 -1.171 . . . . 0.0 112.173 -171.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.457 ' HD2' ' C ' ' A' ' 39' ' ' LEU . 22.3 tptm -67.71 -39.44 84.35 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.373 0.669 . . . . 0.0 109.699 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.446 ' HA ' HD22 ' A' ' 112' ' ' LEU . . . -82.42 -51.45 7.83 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.79 -178.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -61.98 -29.46 70.27 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.953 -177.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 12.0 t60 63.81 77.84 0.31 Allowed 'General case' 0 C--N 1.344 0.349 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 83.2 mtp -101.52 120.15 55.39 Favored Pre-proline 0 C--N 1.301 -1.529 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.469 -173.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -70.11 -19.66 34.15 Favored 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 122.686 2.257 . . . . 0.0 110.401 173.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -99.75 116.23 64.95 Favored Pre-proline 0 N--CA 1.436 -1.148 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.353 175.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -58.0 116.46 3.25 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 122.731 2.287 . . . . 0.0 110.252 178.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -81.09 113.62 19.39 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.155 -172.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.421 -1.875 0 CA-C-N 114.328 -1.306 . . . . 0.0 107.712 177.942 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.304 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 22.0 t70 67.69 -73.18 0.08 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 124.141 0.976 . . . . 0.0 112.978 177.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -82.93 117.31 22.68 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 -177.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.409 ' HB3' HD11 ' A' ' 9' ' ' ILE . 13.3 tp -103.76 160.42 14.79 Favored 'General case' 0 N--CA 1.423 -1.811 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -177.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.7 p -90.64 157.02 17.7 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 122.848 0.459 . . . . 0.0 111.372 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -51.29 -49.84 60.48 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 -174.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -40.67 95.95 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -176.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -67.27 -44.05 80.3 Favored 'General case' 0 C--O 1.211 -0.931 0 O-C-N 123.52 0.513 . . . . 0.0 110.015 176.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.519 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 78.5 mt -62.52 -42.4 95.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.614 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.41 -35.76 81.12 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-O 121.555 0.693 . . . . 0.0 110.205 178.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -63.27 -49.99 71.92 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.923 178.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.464 ' O ' ' HB2' ' A' ' 16' ' ' PHE . 42.1 m-85 -71.12 -24.0 62.2 Favored 'General case' 0 C--O 1.177 -2.759 0 CA-C-N 114.88 -1.054 . . . . 0.0 112.459 -179.187 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.1 mttt -62.95 -40.92 99.12 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 119.056 0.843 . . . . 0.0 110.023 174.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -58.81 -56.38 22.95 Favored 'General case' 0 C--O 1.25 1.1 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.119 178.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.455 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -72.61 -23.76 60.98 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.281 -176.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.464 ' HB2' ' O ' ' A' ' 12' ' ' PHE . 47.5 t80 -64.84 -44.34 90.13 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 177.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.8 t -75.76 -16.94 60.06 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.864 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.455 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 38.6 tp -72.18 -41.51 66.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.054 174.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.442 ' CE1' ' HA ' ' B' ' 100' ' ' ALA . 21.7 m-85 -80.41 -40.45 26.41 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.223 178.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -72.44 99.05 2.38 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.464 ' HE2' HG12 ' A' ' 35' ' ' VAL . 56.3 mttm -83.63 1.73 40.89 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -174.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.578 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 10.4 m-20 -105.68 -13.9 15.42 Favored 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.533 179.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.92 34.52 55.77 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.85 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.578 ' OD2' ' HB2' ' A' ' 22' ' ' ASP . 2.6 p30 -113.29 -16.88 12.44 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -178.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.73 33.6 33.6 Favored Glycine 0 C--N 1.311 -0.809 0 N-CA-C 114.999 0.76 . . . . 0.0 114.999 176.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.7 p -149.28 129.04 13.27 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 171.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 60.0 mt -99.18 120.19 48.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-O 121.298 0.571 . . . . 0.0 112.074 -170.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.0 p -93.45 175.18 6.85 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.993 178.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 46.2 p -67.58 -25.52 65.82 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.493 0.664 . . . . 0.0 109.734 176.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -57.89 -57.05 14.48 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.014 175.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -65.11 -40.73 94.94 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.373 -177.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.5 mt -57.7 -52.55 64.99 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 123.488 0.492 . . . . 0.0 110.547 175.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.79 -31.05 78.59 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.312 -0.947 . . . . 0.0 112.798 -178.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.0 m -72.74 -43.22 63.19 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 117.467 0.634 . . . . 0.0 111.226 178.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.616 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 35.0 m -67.43 -36.06 75.31 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.422 176.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.47 ' SD ' ' HG2' ' A' ' 43' ' ' PRO . 66.2 mtt -67.48 -35.09 78.49 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.187 177.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -61.1 -38.72 87.28 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 174.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.3 t -72.02 -28.3 63.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.809 177.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 80.4 mt -78.91 -20.15 50.09 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.881 0.372 . . . . 0.0 110.505 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.37 32.46 7.36 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 121.373 -0.442 . . . . 0.0 112.27 179.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.449 ' C ' HD22 ' A' ' 42' ' ' ASN . 36.1 tt0 -145.18 139.53 27.3 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.449 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -126.25 80.03 69.21 Favored Pre-proline 0 C--N 1.3 -1.573 0 O-C-N 121.773 -0.579 . . . . 0.0 112.403 -179.058 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.47 ' HG2' ' SD ' ' A' ' 36' ' ' MET . 21.9 Cg_exo -69.82 149.43 66.53 Favored 'Trans proline' 0 C--O 1.242 0.705 0 C-N-CA 121.82 1.68 . . . . 0.0 109.447 173.066 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.1 p -78.95 162.53 25.92 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -174.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -44.49 -56.44 4.29 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 126.162 1.785 . . . . 0.0 113.657 -174.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.95 -34.52 76.74 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -175.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -60.78 -45.47 94.23 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.434 ' O ' HG13 ' A' ' 52' ' ' ILE . 96.7 mt -60.83 -43.19 98.59 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.991 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -73.55 -31.78 63.84 Favored 'General case' 0 N--CA 1.44 -0.927 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.448 -178.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.501 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 31.2 t70 -67.27 -40.06 86.12 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 119.719 -0.792 . . . . 0.0 109.577 175.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.8 tpt -59.37 -37.2 77.3 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.368 175.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 48' ' ' LEU . 45.5 mt -66.41 -50.93 63.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.725 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.772 174.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -59.81 -23.12 63.07 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 124.016 0.926 . . . . 0.0 112.724 -173.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 17.0 mm-40 -62.0 -36.94 83.02 Favored 'General case' 0 N--CA 1.396 -3.143 0 C-N-CA 124.479 1.112 . . . . 0.0 111.164 175.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.544 HG11 ' SD ' ' A' ' 71' ' ' MET . 28.9 m -109.02 -14.41 10.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.761 0.315 . . . . 0.0 111.383 -179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -72.61 114.14 10.42 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.72 -18.91 30.02 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.964 -177.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -97.12 -12.37 23.21 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.57 37.06 88.03 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 -174.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.0 p-10 -101.49 -7.65 22.65 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.36 18.37 28.75 Favored Glycine 0 N--CA 1.436 -1.324 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.937 173.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 p -143.64 142.48 31.04 Favored 'General case' 0 C--O 1.253 1.276 0 CA-C-N 116.731 0.265 . . . . 0.0 110.436 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.9 mt -92.19 108.89 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.64 169.7 15.96 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.437 ' CE2' HD11 ' A' ' 69' ' ' LEU . 52.6 t80 -58.59 -55.88 41.32 Favored Pre-proline 0 CA--C 1.554 1.11 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -176.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.01 -37.08 78.3 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.498 2.132 . . . . 0.0 112.117 176.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -70.25 -39.84 74.79 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.009 0.433 . . . . 0.0 110.433 -178.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' B' ' 100' ' ' ALA . 3.2 t80 -66.08 -39.85 90.36 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.437 HD11 ' CE2' ' A' ' 65' ' ' PHE . 83.4 mt -65.35 -45.24 84.95 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.354 177.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 89.1 m -56.96 -44.71 82.87 Favored 'General case' 0 C--O 1.239 0.535 0 O-C-N 123.466 0.479 . . . . 0.0 109.976 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.544 ' SD ' HG11 ' A' ' 55' ' ' VAL . 32.5 ttp -58.9 -49.13 78.95 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.879 177.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.5 mmt -62.52 -43.84 97.84 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.73 -24.69 66.97 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.087 0.47 . . . . 0.0 111.476 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.9 mtp180 -82.77 -41.54 19.05 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.386 0.613 . . . . 0.0 109.497 175.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 81' ' ' SER . 59.4 tttp -67.99 -28.71 67.67 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.705 -1.134 . . . . 0.0 111.623 -172.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 73.8 mtm -96.16 6.09 49.6 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -133.13 -48.55 0.85 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -178.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -75.11 -77.99 0.11 Allowed 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 122.041 0.924 . . . . 0.0 112.299 -173.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.1 m -147.31 170.91 16.31 Favored 'General case' 0 C--N 1.249 -3.785 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.0 t70 72.89 33.66 1.21 Allowed 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 123.014 1.387 . . . . 0.0 109.147 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.519 ' O ' HG12 ' A' ' 85' ' ' ILE . 22.9 t -120.0 -65.42 1.16 Allowed 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.369 -1.287 . . . . 0.0 109.602 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -63.12 -35.99 82.11 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.526 0.679 . . . . 0.0 110.07 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.55 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 1.6 mp0 -70.23 -33.25 71.43 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.717 178.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -64.02 -46.66 83.51 Favored 'General case' 0 CA--C 1.492 -1.266 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.519 HG12 ' O ' ' A' ' 81' ' ' SER . 6.9 mm -64.73 -35.77 75.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 114.759 -1.11 . . . . 0.0 109.311 -176.315 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.1 ttt180 -64.14 -49.76 70.89 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.444 175.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' A' ' 83' ' ' GLU . 40.4 mm-40 -64.41 -36.15 83.22 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.849 0.356 . . . . 0.0 111.83 -176.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.2 -28.06 67.77 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.583 177.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -80.51 -49.55 11.22 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.594 0.712 . . . . 0.0 109.097 176.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -53.94 -30.91 48.58 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 126.379 1.872 . . . . 0.0 112.681 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.441 HG21 ' O ' ' B' ' 92' ' ' ALA . 14.2 p -70.8 -29.39 37.51 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.641 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -86.24 -49.47 7.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 176.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -88.44 79.33 7.7 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.975 179.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HE2' ' O ' ' A' ' 91' ' ' VAL . 70.7 mmtt -75.53 -30.55 59.81 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.621 -177.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -85.37 -12.48 52.07 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -177.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.81 51.6 6.29 Favored Glycine 0 CA--C 1.502 -0.733 0 C-N-CA 120.77 -0.729 . . . . 0.0 111.678 177.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.418 HD22 ' N ' ' A' ' 97' ' ' ASN . 0.9 OUTLIER -90.31 -17.96 26.43 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 123.073 0.549 . . . . 0.0 110.053 -179.423 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.15 9.56 79.89 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.456 178.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 39.7 p90 -157.28 156.96 33.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.532 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.0 mt -105.21 134.88 45.44 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.0 t -107.59 151.01 26.19 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 177.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.12 -55.87 29.5 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -175.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.0 -26.94 68.5 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.137 0.494 . . . . 0.0 110.965 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -72.95 -40.49 65.35 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.515 177.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.492 ' O ' ' HG2' ' A' ' 109' ' ' MET . 6.4 tt -63.56 -39.43 94.38 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 177.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.453 ' O ' ' HD2' ' A' ' 106' ' ' ARG . 4.2 tmm_? -66.76 -38.49 86.7 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -59.73 -48.75 80.45 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.048 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.609 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.8 p -65.02 -33.42 63.62 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.298 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.099 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.519 ' HG3' HD12 ' A' ' 116' ' ' LEU . 21.7 mmt -59.72 -45.51 91.96 Favored 'General case' 0 CA--C 1.495 -1.137 0 CA-C-O 120.751 0.31 . . . . 0.0 111.569 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 23.7 m -64.69 -29.75 70.75 Favored 'General case' 0 CA--C 1.563 1.459 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.214 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.73 -24.35 41.68 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.105 0.479 . . . . 0.0 111.091 177.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 77.3 mt -89.17 -19.95 24.84 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.722 0.409 . . . . 0.0 111.01 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 99.27 24.97 9.79 Favored Glycine 0 C--N 1.308 -1.014 0 C-N-CA 120.64 -0.791 . . . . 0.0 111.905 -178.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -111.1 154.44 24.27 Favored 'General case' 0 N--CA 1.426 -1.639 0 CA-C-O 121.412 0.625 . . . . 0.0 109.5 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -124.09 104.68 9.01 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.207 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.519 HD12 ' HG3' ' A' ' 109' ' ' MET . 61.7 mt -124.52 151.75 44.27 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 177.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 35.7 p -86.85 169.63 12.38 Favored 'General case' 0 C--N 1.29 -2.012 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.415 ' HA ' HG22 ' A' ' 121' ' ' VAL . 2.2 m-20 -66.18 -35.13 79.66 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -59.96 -43.69 94.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.047 175.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -65.57 -53.65 38.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.885 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.454 ' O ' HG12 ' A' ' 125' ' ' ILE . 23.1 m -65.36 -36.47 77.77 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.566 -176.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -69.08 -34.3 74.91 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 120.893 0.378 . . . . 0.0 110.441 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.41 -40.51 77.25 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.4 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 56.2 mtt -56.62 -50.99 70.37 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.701 176.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 121' ' ' VAL . 48.2 mm -58.02 -45.52 88.07 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 O-C-N 123.919 0.762 . . . . 0.0 109.484 178.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.6 ttp-105 -58.92 -31.74 68.93 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -176.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' A' ' 128' ' ' ALA . 0.4 OUTLIER -79.4 -32.82 43.07 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 117.974 -1.49 . . . . 0.0 109.931 178.357 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.433 ' N ' ' HG3' ' A' ' 127' ' ' GLU . . . -84.75 -24.76 28.67 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.582 -175.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -73.51 89.53 1.69 Allowed 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 124.117 0.967 . . . . 0.0 108.584 175.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 84.7 mt -82.84 -35.85 12.69 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.926 -174.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -81.31 -9.29 59.78 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.561 0.696 . . . . 0.0 111.296 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.08 49.57 15.82 Favored Glycine 0 CA--C 1.499 -0.908 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.697 175.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -115.47 -16.46 11.38 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-O 121.385 0.612 . . . . 0.0 110.942 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.0 5.35 60.97 Favored Glycine 0 C--N 1.304 -1.205 0 N-CA-C 111.097 -0.801 . . . . 0.0 111.097 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -131.73 125.21 31.43 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.532 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.2 p -94.58 111.28 25.14 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.833 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.357 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -85.85 168.98 13.75 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.431 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.576 ' O ' HG13 ' A' ' 142' ' ' VAL . 92.5 t80 -57.18 -45.77 83.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.103 -176.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.471 ' O ' HG22 ' A' ' 142' ' ' VAL . 10.8 pt-20 -61.91 -27.95 69.18 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.31 0.576 . . . . 0.0 111.678 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HG3' ' HG3' ' A' ' 139' ' ' GLU . 38.4 mt-10 -82.39 -41.02 20.47 Favored 'General case' 0 N--CA 1.414 -2.259 0 CA-C-O 122.126 0.965 . . . . 0.0 108.458 -177.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -60.12 -44.65 94.72 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.74 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.576 HG13 ' O ' ' A' ' 138' ' ' TYR . 19.7 m -56.33 -33.85 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 CA-C-O 121.126 0.489 . . . . 0.0 112.193 -177.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -80.09 -50.9 9.68 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.521 -174.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -24.09 63.09 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.408 -176.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 25.9 ttt -79.09 -37.71 38.1 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.646 -0.422 . . . . 0.0 112.004 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 7.6 t -83.89 -18.06 38.7 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 119.926 -0.709 . . . . 0.0 110.014 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -118.0 74.4 0.94 Allowed 'General case' 0 N--CA 1.432 -1.349 0 CA-C-O 121.358 0.599 . . . . 0.0 109.553 177.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm . . . . . 0 N--CA 1.419 -2.005 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 178.821 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 N--CA 1.44 -0.934 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -62.54 -55.74 0.83 Allowed 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.091 1.861 . . . . 0.0 110.245 176.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . 52.89 36.02 20.58 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 123.922 0.889 . . . . 0.0 111.367 175.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -72.0 -20.21 61.75 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.9 -173.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -93.52 -3.13 53.42 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 178.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 65.58 -64.68 0.18 Allowed 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 115.316 1.598 . . . . 0.0 115.316 176.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -62.71 -21.33 65.69 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 119.074 0.852 . . . . 0.0 112.344 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -64.53 -30.26 71.29 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.321 0.581 . . . . 0.0 111.06 176.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.27 -35.82 74.0 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -71.41 -22.65 61.83 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.11 177.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.57 -44.45 90.67 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.4 ' CZ2' ' HB3' ' A' ' 124' ' ' MET . 52.7 m95 -71.06 -36.06 72.16 Favored 'General case' 0 CA--C 1.509 -0.603 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.092 175.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -57.19 -54.08 50.84 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 178.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -59.4 -46.14 89.53 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.573 -1.649 . . . . 0.0 111.104 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.2 -55.84 29.77 Favored 'General case' 0 CA--C 1.503 -0.837 0 O-C-N 123.283 0.364 . . . . 0.0 111.122 -179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.401 ' O ' ' HB2' ' B' ' 93' ' ' LYS . 50.5 mm -60.04 -47.3 92.37 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.711 0 O-C-N 123.524 0.515 . . . . 0.0 110.227 -178.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -54.77 -51.98 64.0 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 123.239 0.616 . . . . 0.0 112.141 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.437 ' HA ' HD22 ' A' ' 39' ' ' LEU . 19.8 tptm -69.84 -35.89 75.11 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.097 0.475 . . . . 0.0 111.572 -178.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.441 ' O ' HG21 ' A' ' 91' ' ' VAL . . . -77.82 -34.16 52.13 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.237 -177.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 8.1 tmtm? -52.83 -48.81 66.73 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.535 1.134 . . . . 0.0 109.362 -178.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 46.41 69.29 0.49 Allowed 'General case' 0 N--CA 1.486 1.334 0 O-C-N 124.42 1.075 . . . . 0.0 113.049 171.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 67.0 mtt -150.36 156.6 37.09 Favored Pre-proline 0 C--N 1.31 -1.11 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -178.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -75.12 -3.73 14.34 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.438 2.092 . . . . 0.0 112.776 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -75.1 124.33 89.33 Favored Pre-proline 0 C--N 1.318 -0.783 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.129 178.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.62 119.42 6.66 Favored 'Trans proline' 0 C--O 1.251 1.133 0 C-N-CA 123.18 2.587 . . . . 0.0 113.234 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 73.2 t-105 -119.72 163.09 17.95 Favored 'General case' 0 N--CA 1.424 -1.757 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . 0.442 ' HA ' ' CE1' ' A' ' 19' ' ' PHE . . . . . . . . 0 N--CA 1.426 -1.643 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 174.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.362 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -138.96 81.68 1.86 Allowed 'General case' 0 C--N 1.297 -1.715 0 CA-C-O 122.527 1.155 . . . . 0.0 109.788 176.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -101.36 96.94 7.5 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.553 ' HG ' ' HB2' ' A' ' 8' ' ' GLN . 9.1 tp -133.3 143.55 49.11 Favored 'General case' 0 N--CA 1.426 -1.635 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -174.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.454 ' OG1' ' HG2' ' A' ' 8' ' ' GLN . 71.4 p -84.44 159.2 20.83 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 119.519 -0.872 . . . . 0.0 109.591 177.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.61 -30.76 71.59 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 111.946 0.351 . . . . 0.0 111.946 -175.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.449 ' CD ' ' H ' ' A' ' 7' ' ' GLU . 1.3 mp0 -57.54 -46.11 84.28 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 177.191 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.553 ' HB2' ' HG ' ' A' ' 4' ' ' LEU . 60.3 mm-40 -65.75 -51.72 56.92 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.408 -179.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.443 ' O ' ' HG2' ' A' ' 13' ' ' LYS . 78.8 mt -57.83 -36.99 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.73 -176.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' ' 13' ' ' LYS . . . -67.26 -40.84 86.26 Favored 'General case' 0 C--O 1.254 1.29 0 CA-C-O 121.594 0.711 . . . . 0.0 110.6 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -64.64 -40.81 96.1 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.375 -0.83 . . . . 0.0 108.995 176.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.406 ' CE2' HD21 ' A' ' 4' ' ' LEU . 36.4 m-85 -60.8 -38.16 84.42 Favored 'General case' 0 C--O 1.162 -3.516 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.307 174.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 10' ' ' ALA . 32.8 mmtp -52.46 -56.47 14.85 Favored 'General case' 0 C--O 1.248 0.996 0 CA-C-N 118.318 0.508 . . . . 0.0 111.155 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -64.85 -51.27 62.99 Favored 'General case' 0 C--O 1.25 1.113 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.18 -37.55 87.87 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.996 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -59.8 -42.63 93.85 Favored 'General case' 0 C--O 1.206 -1.205 0 C-N-CA 123.489 0.716 . . . . 0.0 110.272 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.8 m -68.32 -23.69 64.75 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 123.516 0.51 . . . . 0.0 110.742 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.7 tt -73.27 -31.25 63.96 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 121.365 0.602 . . . . 0.0 109.441 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -87.71 -33.04 18.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.475 179.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -79.52 90.61 5.1 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 173.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -64.47 -47.06 80.39 Favored 'General case' 0 N--CA 1.428 -1.546 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 -170.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.429 ' OD2' ' HB3' ' A' ' 24' ' ' ASP . 6.7 p-10 -83.2 -13.23 55.84 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.161 -178.112 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.64 58.5 6.35 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 116.008 -0.542 . . . . 0.0 113.145 177.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.429 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 4.8 p-10 -113.62 -15.91 12.43 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 120.991 0.424 . . . . 0.0 110.064 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.33 10.49 38.76 Favored Glycine 0 N--CA 1.43 -1.732 0 CA-C-N 115.962 -0.563 . . . . 0.0 113.955 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 71.2 p -136.75 160.53 38.58 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 118.02 0.91 . . . . 0.0 108.987 175.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.0 mt -120.96 120.4 62.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.152 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.6 p -95.13 175.41 6.63 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.616 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 p -59.2 -42.75 91.66 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 123.605 0.762 . . . . 0.0 110.606 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -58.73 -44.76 90.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.888 178.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -67.48 -38.69 84.76 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.772 -179.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.23 -46.71 89.27 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.146 176.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.4 -25.19 75.71 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.443 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.9 m -66.71 -54.55 21.77 Favored 'General case' 0 C--O 1.251 1.162 0 CA-C-O 121.31 0.576 . . . . 0.0 109.633 176.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 28.2 m -67.34 -36.13 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.145 -178.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.411 ' HB3' ' O ' ' A' ' 41' ' ' GLN . 49.7 mtt -66.48 -44.4 82.79 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 177.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -59.46 -36.38 75.86 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.0 t -67.62 -14.0 62.56 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.005 179.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 59.6 mt -103.2 -11.57 17.92 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.327 177.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.09 -7.07 32.7 Favored Glycine 0 C--N 1.311 -0.851 0 C-N-CA 120.091 -1.052 . . . . 0.0 114.122 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.48 ' NE2' ' HB3' ' B' ' 96' ' ' PRO . 0.0 OUTLIER -107.56 131.3 54.5 Favored 'General case' 0 CA--C 1.483 -1.633 0 CA-C-N 118.013 0.907 . . . . 0.0 110.724 177.739 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.34 3.5 p30 -135.0 71.69 68.9 Favored Pre-proline 0 C--N 1.284 -2.28 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 173.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.87 157.19 25.11 Favored 'Trans proline' 0 C--N 1.357 1.016 0 C-N-CA 123.276 2.651 . . . . 0.0 111.472 173.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 72.5 p -78.17 165.18 24.26 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.425 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.84 -40.83 70.02 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 123.541 0.736 . . . . 0.0 112.04 -179.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.68 -43.75 93.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.188 0.518 . . . . 0.0 110.958 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -64.16 -42.66 96.65 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.544 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 87.7 mt -70.41 -38.59 74.64 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.306 -179.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -64.26 -40.49 96.09 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 123.151 0.58 . . . . 0.0 109.603 177.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.59 -35.56 78.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.76 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.507 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 66.5 mmm -74.38 -33.62 63.1 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.822 177.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.5 mt -66.97 -40.81 86.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 121.371 0.605 . . . . 0.0 109.481 175.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.423 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.9 t30 -63.66 -12.46 34.09 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.254 -178.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.507 ' HB2' ' O ' ' A' ' 51' ' ' MET . 12.2 mm-40 -67.21 -23.54 65.75 Favored 'General case' 0 N--CA 1.394 -3.268 0 C-N-CA 123.742 0.817 . . . . 0.0 111.354 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.541 ' CG1' ' HB2' ' A' ' 71' ' ' MET . 17.4 m -119.58 -19.94 5.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.973 174.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.423 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 11.3 t70 -78.46 82.28 4.74 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.771 0.796 . . . . 0.0 111.843 -173.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.92 -21.81 26.06 Favored 'General case' 0 C--N 1.299 -1.621 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.434 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -81.78 -11.97 58.76 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.34 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.77 12.54 84.42 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 115.41 0.924 . . . . 0.0 115.41 173.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -80.48 -14.29 58.39 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.962 1.381 . . . . 0.0 110.395 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 79.75 20.34 68.62 Favored Glycine 0 N--CA 1.437 -1.279 0 CA-C-N 115.843 -0.617 . . . . 0.0 113.432 176.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.97 148.19 39.95 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.2 mt -92.26 116.17 32.82 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 108.758 -0.831 . . . . 0.0 108.758 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.44 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 7.1 t70 -87.14 172.53 9.87 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 174.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.444 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 46.7 t80 -57.13 -51.65 80.07 Favored Pre-proline 0 CA--C 1.555 1.168 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -175.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.44 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 8.7 Cg_endo -51.58 -42.48 55.81 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 122.973 2.448 . . . . 0.0 112.6 175.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.85 -39.63 87.66 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.632 0.729 . . . . 0.0 110.067 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -66.38 -40.66 89.84 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.598 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 78.0 mt -63.73 -37.78 88.66 Favored 'General case' 0 C--O 1.206 -1.196 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.987 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.438 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 86.5 m -59.22 -50.88 72.32 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 123.493 0.496 . . . . 0.0 110.912 178.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.541 ' HB2' ' CG1' ' A' ' 55' ' ' VAL . 34.0 ttp -66.03 -36.65 83.82 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.053 0.454 . . . . 0.0 111.84 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.5 mmt -82.22 -24.87 34.64 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.786 -0.766 . . . . 0.0 112.334 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.71 -29.89 67.39 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 173.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.725 ' HA ' ' O ' ' A' ' 78' ' ' ASP . 99.8 mtt180 -66.24 -29.86 70.19 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.731 0.777 . . . . 0.0 109.529 174.034 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -81.94 -12.14 58.53 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.937 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.9 ttm -104.34 -85.99 0.46 Allowed 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.484 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -141.51 15.47 2.18 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -173.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.725 ' O ' ' HA ' ' A' ' 74' ' ' ARG . 23.1 t70 -127.96 162.23 27.27 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.2 m -152.44 157.65 41.49 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 176.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -101.98 -55.01 2.58 Favored 'General case' 0 CA--C 1.499 -0.988 0 CA-C-N 118.772 0.715 . . . . 0.0 110.398 -178.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.8 m -121.22 -165.78 1.27 Allowed 'General case' 0 N--CA 1.412 -2.355 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.3 -178.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.493 ' H ' ' CD ' ' A' ' 82' ' ' GLU . 0.2 OUTLIER -100.34 -1.07 37.07 Favored 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 177.356 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.601 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 44.0 mt-10 -62.84 -58.47 7.29 Favored 'General case' 0 CA--C 1.489 -1.377 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.943 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -49.6 -45.36 47.94 Favored 'General case' 0 C--O 1.251 1.156 0 C-N-CA 124.817 1.247 . . . . 0.0 110.376 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.531 HG21 HG12 ' A' ' 142' ' ' VAL . 40.0 mm -66.75 -50.73 63.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 114.416 -1.265 . . . . 0.0 110.426 -177.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -70.66 -27.68 64.22 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.138 -177.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.601 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 51.4 mt-10 -60.08 -44.9 94.44 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 175.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.34 -38.11 81.17 Favored 'General case' 0 C--O 1.21 -1.008 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.831 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.76 -43.6 83.62 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.404 0.621 . . . . 0.0 110.139 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 -66.23 -26.76 67.52 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 124.739 1.216 . . . . 0.0 111.7 -176.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.0 p -83.76 -19.76 9.39 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 C-N-CA 120.308 -0.557 . . . . 0.0 111.287 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -91.3 -49.78 6.17 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 122.037 -0.414 . . . . 0.0 110.012 177.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -84.42 107.38 16.65 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 177.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -73.28 -26.62 61.16 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.342 -172.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -103.81 -14.18 16.14 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.529 0.68 . . . . 0.0 110.789 -176.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 70.04 45.15 58.14 Favored Glycine 0 N--CA 1.43 -1.725 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -176.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -85.61 -17.83 35.03 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 121.427 0.632 . . . . 0.0 109.644 -177.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 101.45 16.08 25.7 Favored Glycine 0 N--CA 1.434 -1.449 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.515 173.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -146.71 131.39 17.88 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -177.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.475 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.1 mt -100.68 126.93 54.24 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.5 t -107.24 144.72 33.63 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.46 94.21 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.208 0.603 . . . . 0.0 111.782 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.56 89.09 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.093 0.473 . . . . 0.0 110.802 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.531 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 5.0 tp10 -72.15 -45.36 60.8 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.498 178.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.506 ' O ' ' HG2' ' A' ' 109' ' ' MET . 8.5 tt -60.23 -37.81 81.49 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 -176.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.487 ' HB2' HG21 ' A' ' 121' ' ' VAL . 45.8 ttt180 -63.14 -37.15 86.06 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.727 177.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.531 ' HB2' ' O ' ' A' ' 104' ' ' GLU . 56.7 m170 -51.98 -53.51 40.66 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.365 177.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.58 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.3 p -71.02 -30.61 42.01 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.621 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.335 -176.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.506 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 20.2 mmt -63.6 -47.02 83.16 Favored 'General case' 0 CA--C 1.494 -1.209 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.7 m -62.11 -32.75 73.35 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.406 177.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -73.48 -33.57 64.89 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.216 177.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 84.9 mt -84.65 -20.87 30.62 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.009 0.433 . . . . 0.0 110.986 -176.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 89.48 18.12 53.23 Favored Glycine 0 N--CA 1.431 -1.685 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.1 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -84.58 107.57 16.87 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 176.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -70.3 99.63 1.58 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.4 -177.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 62.9 mt -137.1 149.04 47.09 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.3 p -89.86 173.83 8.03 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -66.94 -34.17 77.19 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -61.28 -47.41 86.13 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.519 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -62.68 -48.76 77.91 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.459 -177.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.487 HG21 ' HB2' ' A' ' 106' ' ' ARG . 17.2 m -66.96 -33.42 63.27 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 CA-C-O 121.014 0.435 . . . . 0.0 110.9 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -74.35 -37.12 63.59 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.0 0.429 . . . . 0.0 109.971 178.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.626 ' HG3' ' CE1' ' B' ' 81' ' ' PHE . 8.3 tp10 -61.44 -41.6 97.45 Favored 'General case' 0 C--O 1.248 1.025 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.427 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 62.3 mtt -53.71 -56.83 13.9 Favored 'General case' 0 CA--C 1.504 -0.804 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.752 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.9 mm -57.9 -50.57 77.38 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.724 0 CA-C-N 114.482 -1.236 . . . . 0.0 111.451 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -61.43 -21.67 64.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.501 ' HB2' ' CE1' ' B' ' 81' ' ' PHE . 15.1 tp10 -83.81 -36.91 23.16 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.795 176.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.86 -31.04 40.41 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 120.904 0.383 . . . . 0.0 110.525 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.38 94.65 0.96 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.208 1.403 . . . . 0.0 109.532 175.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.67 -38.89 15.39 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.921 -176.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -74.76 -10.71 59.77 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.777 -176.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.72 45.63 27.38 Favored Glycine 0 N--CA 1.441 -0.984 0 C-N-CA 120.664 -0.779 . . . . 0.0 111.538 178.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -105.37 -15.94 14.89 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.858 0.837 . . . . 0.0 109.664 -176.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.03 5.04 73.98 Favored Glycine 0 CA--C 1.495 -1.176 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -143.71 125.53 15.16 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.475 HG13 ' HB ' ' A' ' 100' ' ' ILE . 0.4 OUTLIER -89.21 128.18 41.44 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.274 0 O-C-N 123.556 0.535 . . . . 0.0 110.131 -179.473 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -91.12 170.97 9.58 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.977 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.624 ' O ' HG13 ' A' ' 142' ' ' VAL . 81.6 t80 -54.34 -44.79 72.41 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -175.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -68.58 -25.53 64.93 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HB2' HG23 ' A' ' 136' ' ' VAL . 51.7 mt-10 -81.27 -39.1 25.79 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 176.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -67.22 -43.03 83.04 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.699 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.624 HG13 ' O ' ' A' ' 138' ' ' TYR . 27.1 m -53.78 -36.52 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -68.83 -42.21 77.5 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.765 -177.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 27.9 ttt -86.5 -30.24 22.13 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.41 -178.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.412 ' SD ' HG21 ' B' ' 89' ' ' ILE . 14.5 tpt -68.69 -26.56 65.35 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.313 178.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 15.3 t -81.17 -34.8 32.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.191 177.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -113.23 105.43 13.42 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -173.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.413 ' HA ' ' HD2' ' B' ' 82' ' ' LYS . 3.1 mppt? . . . . . 0 C--N 1.31 -1.126 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 176.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 14.3 p . . . . . 0 N--CA 1.44 -0.964 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -36.79 99.62 0.03 OUTLIER 'Trans proline' 0 C--N 1.385 2.455 0 C-N-CA 125.073 3.849 . . . . 0.0 115.341 -178.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' B' ' 79' ' ' PHE . . . -156.46 17.42 0.33 Allowed 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.856 177.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -102.8 -46.59 4.66 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.16 -175.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 16.1 m -83.22 -40.49 19.56 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.424 ' O ' ' HA ' ' B' ' 76' ' ' ALA . 86.6 m-85 -134.41 145.44 48.91 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 174.343 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 28.6 m80 -82.68 21.36 1.0 Allowed 'General case' 0 C--N 1.287 -2.131 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -169.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . 0.626 ' CE1' ' HG3' ' A' ' 123' ' ' GLU . 54.3 m-85 -39.13 -59.25 1.03 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 116.072 1.879 . . . . 0.0 116.072 -170.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . 0.413 ' HD2' ' HA ' ' A' ' 148' ' ' LYS . 30.4 mmtp -76.72 -29.33 56.16 Favored 'General case' 0 C--N 1.315 -0.934 0 C-N-CA 118.768 -1.173 . . . . 0.0 113.186 -173.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . 0.436 ' O ' ' HB3' ' B' ' 86' ' ' LYS . 37.1 mt-10 -81.63 -27.43 34.14 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.189 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.8 -50.88 54.51 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.556 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.528 ' O ' HG12 ' B' ' 89' ' ' ILE . 84.5 m95 -63.66 -32.19 73.6 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.487 176.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' B' ' 83' ' ' GLU . 37.8 ttpt -54.09 -58.45 7.27 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 175.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -57.35 -45.54 84.24 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 114.28 -1.327 . . . . 0.0 111.78 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.93 -61.5 2.34 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 124.402 1.064 . . . . 0.0 112.501 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.528 HG12 ' O ' ' B' ' 85' ' ' TRP . 36.7 pt -65.14 -36.26 77.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -174.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . 0.467 ' HB3' ' O ' ' B' ' 95' ' ' MET . 26.3 mt-30 -64.33 -55.93 17.91 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.414 ' CG ' ' HB3' ' A' ' 112' ' ' LEU . 3.4 tppp? -68.32 -31.54 71.03 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.645 -174.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.88 -37.34 73.03 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.873 178.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -77.89 -1.6 32.58 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-O 121.876 0.846 . . . . 0.0 109.961 177.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 20.7 t60 71.39 29.4 2.74 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.119 1.368 . . . . 0.0 110.076 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.467 ' O ' ' HB3' ' B' ' 90' ' ' GLN . 59.6 ttp -113.56 95.59 37.04 Favored Pre-proline 0 N--CA 1.425 -1.683 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 176.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.48 ' HB3' ' NE2' ' A' ' 41' ' ' GLN . 88.3 Cg_exo -48.21 -74.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.957 2.438 . . . . 0.0 112.361 -177.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 16.6 t70 177.11 99.13 0.12 Allowed Pre-proline 0 CA--C 1.513 -0.465 0 C-N-CA 123.107 0.563 . . . . 0.0 110.037 172.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -103.4 38.14 0.05 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.39 0 C-N-CA 122.895 2.397 . . . . 0.0 109.181 173.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 27.6 t90 -96.63 121.89 38.95 Favored 'General case' 0 CA--C 1.485 -1.526 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.849 -174.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.409 -2.499 0 CA-C-N 114.27 -1.332 . . . . 0.0 108.422 177.976 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 111.253 0.094 . . . . 0.0 111.253 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -138.96 -7.4 1.4 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 173.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -72.36 114.47 10.51 Favored 'General case' 0 CA--C 1.501 -0.935 0 CA-C-O 121.449 0.642 . . . . 0.0 110.339 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.7 tp -132.65 139.58 47.79 Favored 'General case' 0 C--N 1.275 -2.665 0 N-CA-C 103.891 -2.633 . . . . 0.0 103.891 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.2 p -68.18 148.02 51.45 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.602 -0.839 . . . . 0.0 109.254 -177.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -61.94 -25.66 67.73 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.0 0.429 . . . . 0.0 110.591 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -64.94 -51.23 62.99 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.034 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -65.52 -35.17 80.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.788 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.532 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 51.5 mt -67.57 -32.31 56.41 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.269 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.125 177.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.59 -40.53 88.94 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 175.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.45 -43.07 97.22 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.063 175.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -73.61 -15.41 61.27 Favored 'General case' 0 C--O 1.169 -3.179 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 68.6 mttm -72.97 -42.99 62.78 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 119.251 0.932 . . . . 0.0 108.636 175.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -62.36 -50.07 73.03 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.51 175.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.418 ' HB1' ' HB1' ' B' ' 100' ' ' ALA . . . -63.64 -40.74 97.62 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.137 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.445 ' HD2' ' CD2' ' A' ' 68' ' ' PHE . 92.8 t80 -60.17 -48.63 80.93 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 123.289 0.636 . . . . 0.0 110.094 178.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 m -69.3 -17.52 63.74 Favored 'General case' 0 C--N 1.315 -0.895 0 O-C-N 123.426 0.453 . . . . 0.0 111.464 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.88 -34.88 78.75 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 174.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.596 ' CD2' HG21 ' A' ' 35' ' ' VAL . 17.1 m-85 -90.31 -44.98 9.34 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.001 177.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -87.27 83.34 7.39 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -71.55 -15.57 62.29 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -170.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.484 ' OD1' ' HB3' ' A' ' 24' ' ' ASP . 4.3 p-10 -97.37 -9.85 26.65 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 118.885 -1.126 . . . . 0.0 110.007 177.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.87 50.58 66.0 Favored Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.403 -0.817 . . . . 0.0 113.373 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.484 ' HB3' ' OD1' ' A' ' 22' ' ' ASP . 1.2 p-10 -104.08 -17.3 14.99 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.544 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.54 2.53 50.25 Favored Glycine 0 N--CA 1.436 -1.35 0 C-N-CA 120.022 -1.085 . . . . 0.0 114.513 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 52.9 p -137.31 129.44 29.32 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.606 1.203 . . . . 0.0 109.346 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.1 mt -96.29 122.21 47.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 -174.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -94.84 163.44 13.34 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.039 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 34.1 p -63.55 -30.85 71.91 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.801 0.334 . . . . 0.0 111.5 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -59.93 -46.48 89.25 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.134 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -63.18 -46.87 85.09 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.462 ' HB3' HD22 ' A' ' 48' ' ' LEU . 92.7 mt -54.15 -55.57 26.53 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.21 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.7 -31.56 76.31 Favored Glycine 0 C--N 1.305 -1.165 0 C-N-CA 119.328 -1.415 . . . . 0.0 113.131 -176.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 48.5 m -66.02 -46.73 76.85 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 117.04 0.42 . . . . 0.0 110.569 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.596 HG21 ' CD2' ' A' ' 19' ' ' PHE . 34.1 m -70.02 -37.34 72.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.108 178.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.412 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 1.9 mpp? -64.62 -39.83 94.4 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.528 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.545 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 22.3 ttt180 -66.49 -34.02 76.99 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 121.091 0.472 . . . . 0.0 110.148 178.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.8 m -69.69 -25.68 64.0 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.547 -0.752 . . . . 0.0 109.716 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.6 mt -87.29 -1.62 58.04 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.972 177.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 102.34 -10.0 56.29 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.679 176.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.545 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 60.9 tt0 -95.76 138.85 32.82 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -177.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.443 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -117.95 81.68 16.19 Favored Pre-proline 0 C--N 1.301 -1.543 0 O-C-N 121.609 -0.682 . . . . 0.0 109.822 177.446 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -84.85 149.78 11.05 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 122.293 1.995 . . . . 0.0 111.793 178.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.3 p -90.27 170.28 10.4 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.322 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -55.35 -47.36 75.84 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.447 1.099 . . . . 0.0 110.073 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -45.34 84.13 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.776 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 51' ' ' MET . 42.9 mt-10 -65.61 -44.25 87.09 Favored 'General case' 0 C--O 1.221 -0.431 0 O-C-N 123.655 0.597 . . . . 0.0 111.557 -177.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.462 HD22 ' HB3' ' A' ' 32' ' ' LEU . 88.9 mt -69.02 -39.27 79.37 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.277 -177.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -71.25 -33.74 70.11 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -62.89 -36.88 84.8 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.413 0.625 . . . . 0.0 109.394 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.497 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 94.8 mmm -67.51 -47.37 70.19 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.222 177.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 58.5 mt -59.59 -44.12 92.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.18 0.514 . . . . 0.0 110.444 178.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.503 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 10.1 t30 -55.55 -28.52 55.36 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 114.908 1.448 . . . . 0.0 114.908 -173.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 51' ' ' MET . 9.5 pt-20 -69.04 -27.24 65.48 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 119.198 -1.001 . . . . 0.0 112.591 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.513 HG11 ' HB2' ' A' ' 71' ' ' MET . 34.7 m -101.67 -11.81 8.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.579 0.705 . . . . 0.0 109.794 177.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.503 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 25.9 t70 -87.92 75.7 8.78 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.423 -173.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.6 -20.57 39.52 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.606 0.717 . . . . 0.0 109.798 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -82.38 -6.96 59.61 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.312 178.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 59.54 43.46 97.57 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 115.895 1.118 . . . . 0.0 115.895 172.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -109.64 -1.33 18.17 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 119.252 -0.979 . . . . 0.0 110.721 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 69.34 23.15 76.48 Favored Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.603 -0.726 . . . . 0.0 113.423 176.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -141.29 149.77 41.68 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 52.3 mt -103.87 114.79 44.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.422 ' HB2' ' HD2' ' A' ' 66' ' ' PRO . 1.2 p30 -78.68 163.25 25.6 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 119.724 -0.791 . . . . 0.0 110.261 174.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.5 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 31.8 t80 -54.21 -50.5 84.3 Favored Pre-proline 0 C--N 1.313 -1.017 0 O-C-N 123.913 0.758 . . . . 0.0 110.879 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.5 ' HD3' ' HB3' ' A' ' 65' ' ' PHE . 59.5 Cg_exo -47.2 -51.58 9.21 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 122.233 1.955 . . . . 0.0 112.739 171.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.08 -47.13 81.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.324 0.583 . . . . 0.0 110.468 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.445 ' CD2' ' HD2' ' A' ' 16' ' ' PHE . 37.4 t80 -61.56 -42.99 99.65 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.31 -177.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 90.9 mt -63.61 -44.14 94.83 Favored 'General case' 0 CA--C 1.504 -0.804 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.542 177.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.0 m -59.25 -47.72 84.3 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.778 0.674 . . . . 0.0 109.843 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.513 ' HB2' HG11 ' A' ' 55' ' ' VAL . 36.2 ttp -60.96 -41.33 96.13 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.428 179.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 21.3 mmt -69.27 -42.45 75.52 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 178.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.31 -39.63 93.63 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.816 0.341 . . . . 0.0 110.303 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -61.77 -39.59 92.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.927 175.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -80.63 -3.52 50.76 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 122.228 1.013 . . . . 0.0 110.445 -175.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 51.5 ttm -102.63 -1.36 30.36 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-O 121.798 0.809 . . . . 0.0 108.885 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -139.2 22.31 2.58 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 122.104 0.954 . . . . 0.0 109.415 -178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -103.76 -15.67 15.66 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.994 0.902 . . . . 0.0 111.108 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 28.2 m -84.58 -20.66 31.11 Favored 'General case' 0 C--N 1.263 -3.174 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.17 -170.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -82.06 -12.79 58.07 Favored 'General case' 0 C--N 1.31 -1.141 0 C-N-CA 119.877 -0.729 . . . . 0.0 109.781 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.1 m -105.27 1.78 28.39 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 172.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 54.68 29.87 12.38 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.078 1.351 . . . . 0.0 113.607 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.465 ' O ' ' HB2' ' A' ' 87' ' ' GLU . 51.2 mm-40 -52.48 -62.42 1.65 Allowed 'General case' 0 C--O 1.202 -1.409 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -179.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -48.16 -45.82 33.92 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.228 1.011 . . . . 0.0 111.464 178.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.401 ' HA ' ' HG2' ' A' ' 145' ' ' MET . 4.5 mm -69.8 -52.42 31.67 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.012 -171.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.4 ttp180 -75.97 -22.27 56.1 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.278 -177.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 6.4 tp10 -64.6 -52.27 58.4 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 176.05 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.418 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -62.6 -37.91 88.1 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 114.484 -1.235 . . . . 0.0 110.231 179.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -65.15 -46.56 80.38 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.457 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -69.73 -27.56 65.06 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.646 0.778 . . . . 0.0 112.752 -175.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.418 HG12 ' O ' ' A' ' 88' ' ' ALA . 13.7 p -72.97 -20.13 18.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 119.464 -0.895 . . . . 0.0 110.438 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -91.5 -60.57 1.85 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 173.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.43 ' CG ' ' H ' ' A' ' 97' ' ' ASN . 14.0 t0 -86.81 82.72 7.73 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 122.689 1.233 . . . . 0.0 109.224 177.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -78.11 -29.64 49.07 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.949 -174.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -85.68 -13.06 49.68 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-O 121.356 0.598 . . . . 0.0 110.329 -174.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.98 63.34 2.31 Favored Glycine 0 N--CA 1.426 -2.013 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 179.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.43 ' H ' ' CG ' ' A' ' 93' ' ' ASP . 38.5 m-80 -92.33 -19.17 22.41 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.55 13.68 79.7 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -166.62 153.49 9.07 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 124.316 1.046 . . . . 0.0 109.587 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.457 ' HB ' HG13 ' A' ' 136' ' ' VAL . 2.4 mt -110.94 128.3 67.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 19.1 m -103.53 160.36 14.8 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.09 -45.01 94.13 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 122.256 0.222 . . . . 0.0 111.338 -178.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.44 -43.8 88.91 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 123.75 0.656 . . . . 0.0 110.302 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -57.76 -56.58 20.09 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.094 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.441 ' O ' ' HG2' ' A' ' 109' ' ' MET . 3.0 tm? -58.68 -44.65 90.28 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.295 -1.321 . . . . 0.0 108.995 -173.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.514 ' HB2' HG21 ' A' ' 121' ' ' VAL . 27.8 ttp180 -61.0 -48.74 80.41 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.905 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -60.16 -39.48 86.55 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.472 -178.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.572 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 10.0 p -73.32 -34.3 43.29 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.384 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.488 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.593 ' HG3' HD12 ' A' ' 116' ' ' LEU . 23.1 mmt -63.8 -41.87 97.82 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-N 116.741 -0.209 . . . . 0.0 111.415 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.7 m -62.28 -35.73 79.89 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 176.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -68.81 -33.68 74.25 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.435 0.636 . . . . 0.0 110.381 176.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 52.9 mt -82.86 -16.75 46.4 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.331 -176.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.15 34.86 13.38 Favored Glycine 0 N--CA 1.427 -1.932 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.77 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -103.42 140.69 37.13 Favored 'General case' 0 N--CA 1.418 -2.03 0 C-N-CA 119.722 -0.791 . . . . 0.0 109.795 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -81.43 23.9 0.59 Allowed 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 114.51 -1.223 . . . . 0.0 113.035 -173.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.593 HD12 ' HG3' ' A' ' 109' ' ' MET . 13.9 mt -69.01 132.86 47.32 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 120.605 0.241 . . . . 0.0 110.517 -175.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.8 p -80.43 167.25 20.41 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.018 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -64.47 -28.69 69.84 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 176.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -65.18 -55.11 20.47 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.788 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -55.67 -51.4 67.38 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 123.848 0.717 . . . . 0.0 110.884 -177.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.514 HG21 ' HB2' ' A' ' 106' ' ' ARG . 15.2 m -61.22 -37.31 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.354 -177.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -72.51 -44.63 61.95 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.35 0.595 . . . . 0.0 109.709 -178.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.503 ' OE1' ' HD3' ' A' ' 126' ' ' ARG . 4.7 tp10 -67.38 -36.19 80.85 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.253 -176.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.442 ' HE2' ' HB1' ' B' ' 84' ' ' ALA . 52.3 mtt -56.13 -54.91 39.4 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.014 174.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.6 mm -57.74 -48.52 83.34 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.81 0 O-C-N 124.226 0.954 . . . . 0.0 110.42 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.503 ' HD3' ' OE1' ' A' ' 123' ' ' GLU . 57.0 ttt180 -59.42 -37.86 79.14 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 123.743 0.817 . . . . 0.0 112.494 -176.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.496 ' HG3' ' CE2' ' B' ' 81' ' ' PHE . 19.0 mm-40 -81.65 -25.14 35.86 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 178.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.88 -28.88 39.89 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 176.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.12 85.35 4.31 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 114.362 -1.29 . . . . 0.0 108.725 173.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 53.9 mt -77.46 -23.9 14.52 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.966 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.35 -176.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -86.5 -10.79 53.36 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 120.503 -0.479 . . . . 0.0 112.197 -175.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.2 41.08 22.64 Favored Glycine 0 C--N 1.317 -0.507 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.474 175.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -101.59 -16.14 16.84 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.73 0.776 . . . . 0.0 109.63 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 96.89 -11.19 66.19 Favored Glycine 0 N--CA 1.441 -0.98 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.471 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -136.36 131.28 34.04 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -178.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.457 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.5 p -80.73 113.65 20.47 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-O 120.817 0.341 . . . . 0.0 111.761 -177.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -88.46 178.09 6.64 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.506 ' O ' HG13 ' A' ' 142' ' ' VAL . 85.7 t80 -66.76 -39.89 88.04 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -175.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.513 ' O ' HG22 ' A' ' 142' ' ' VAL . 22.5 mm-40 -67.2 -28.82 68.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.321 0.582 . . . . 0.0 110.857 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.11 -33.3 44.48 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.414 0.626 . . . . 0.0 110.367 175.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -75.33 -29.87 60.12 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.831 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 139' ' ' GLU . 31.7 m -60.0 -33.48 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-O 121.247 0.546 . . . . 0.0 110.612 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -71.79 -40.15 69.4 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.729 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 95.9 mmm -69.31 -39.08 78.46 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.172 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.401 ' HG2' ' HA ' ' A' ' 85' ' ' ILE . 15.5 tpt -67.21 -22.92 65.7 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.62 0.724 . . . . 0.0 110.317 -179.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 7.4 m -96.13 9.28 41.41 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 121.795 0.807 . . . . 0.0 109.714 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -100.78 42.23 1.13 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.3 0.571 . . . . 0.0 110.273 -178.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt . . . . . 0 C--N 1.311 -1.082 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.294 -179.476 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 12.1 m . . . . . 0 CA--C 1.543 0.691 0 CA-C-O 120.798 0.332 . . . . 0.0 110.784 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -80.15 -14.17 12.22 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.213 2.609 . . . . 0.0 114.319 -177.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -77.94 28.41 0.17 Allowed 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -175.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -146.53 113.39 6.09 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.2 m -106.31 10.81 31.56 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.133 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -77.15 159.69 29.56 Favored 'General case' 0 C--O 1.248 1.019 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -175.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 73.5 t60 -67.52 -21.2 65.49 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 114.486 -1.233 . . . . 0.0 111.808 -179.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . 0.496 ' CE2' ' HG3' ' A' ' 127' ' ' GLU . 80.0 m-85 -70.55 -23.84 62.69 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -176.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -68.61 -44.29 74.59 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 173.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.16 -47.59 79.27 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.442 ' HB1' ' HE2' ' A' ' 124' ' ' MET . . . -55.75 -58.79 6.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.26 -1.337 . . . . 0.0 111.723 -178.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -67.6 -33.0 74.12 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -56.13 -57.94 10.03 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 175.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -58.44 -40.31 82.23 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.011 -1.45 . . . . 0.0 110.679 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.1 -54.43 44.71 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.803 0.335 . . . . 0.0 111.312 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 80.9 mt -62.78 -38.97 83.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.548 0.69 . . . . 0.0 109.505 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . 0.432 ' O ' ' HA ' ' B' ' 94' ' ' HIS . 6.2 tt0 -58.03 -42.91 86.34 Favored 'General case' 0 C--N 1.31 -1.128 0 C-N-CA 124.952 1.301 . . . . 0.0 111.548 177.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -81.0 -42.73 20.7 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.829 -177.085 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.32 -52.34 9.34 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -175.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 18.0 ttpt -91.41 -11.02 38.94 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -174.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.432 ' HA ' ' O ' ' B' ' 90' ' ' GLN . 62.1 m170 70.99 100.27 0.06 Allowed 'General case' 0 CA--C 1.502 -0.897 0 C-N-CA 124.021 0.929 . . . . 0.0 110.035 -172.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.494 ' N ' ' HD3' ' B' ' 96' ' ' PRO . 26.7 ttt -129.21 65.52 74.37 Favored Pre-proline 0 C--N 1.312 -1.057 0 C-N-CA 119.022 -1.071 . . . . 0.0 113.687 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.494 ' HD3' ' N ' ' B' ' 95' ' ' MET . 44.4 Cg_endo -106.36 41.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 124.087 3.191 . . . . 0.0 106.291 164.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -65.06 137.54 97.11 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 112.974 -1.921 . . . . 0.0 111.149 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.51 62.4 2.19 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.997 2.465 . . . . 0.0 111.083 176.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 23.9 t90 -76.46 79.63 3.17 Favored 'General case' 0 N--CA 1.426 -1.632 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.983 -178.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . 0.545 ' HA ' ' CE1' ' A' ' 19' ' ' PHE . . . . . . . . 0 C--O 1.257 1.449 0 CA-C-N 113.576 -1.647 . . . . 0.0 111.551 -178.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.428 0 N-CA-C 111.284 0.105 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -144.98 -164.9 2.03 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.786 -178.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 81.31 100.73 0.06 Allowed 'General case' 0 C--O 1.24 0.558 0 C-N-CA 125.737 1.615 . . . . 0.0 108.759 -172.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.449 ' HB3' HD11 ' A' ' 9' ' ' ILE . 19.6 tp -108.62 163.48 13.2 Favored 'General case' 0 N--CA 1.42 -1.929 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.436 -172.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.1 p -85.02 145.14 27.85 Favored 'General case' 0 N--CA 1.413 -2.308 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.574 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.441 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.2 mp0 -51.69 -40.24 59.73 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 125.438 1.495 . . . . 0.0 111.969 -176.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.81 -45.36 89.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.889 -178.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.671 ' HA ' HE21 ' A' ' 8' ' ' GLN . 0.0 OUTLIER -65.88 -45.85 80.57 Favored 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 176.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.553 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 74.8 mt -57.11 -44.26 82.88 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.352 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.856 -178.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.55 93.6 Favored 'General case' 0 C--O 1.256 1.427 0 CA-C-O 121.393 0.616 . . . . 0.0 111.44 177.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.38 -40.59 96.97 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.664 0.745 . . . . 0.0 109.135 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -73.79 -18.78 60.92 Favored 'General case' 0 C--O 1.189 -2.087 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.509 -178.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.553 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 98.6 mttt -65.69 -50.78 63.67 Favored 'General case' 0 CA--C 1.504 -0.819 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -45.34 88.4 Favored 'General case' 0 C--O 1.256 1.409 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.941 177.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.68 87.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.607 179.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -61.99 -45.57 93.06 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.9 m -68.58 -18.1 64.26 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.957 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -67.18 -41.9 85.12 Favored 'General case' 0 C--O 1.243 0.739 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 172.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.428 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 79.3 m-85 -81.44 -50.94 8.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.872 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -63.41 101.34 0.31 Allowed 'General case' 0 CA--C 1.502 -0.887 0 O-C-N 124.293 0.996 . . . . 0.0 109.038 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 19' ' ' PHE . 41.7 mmtm -71.94 -9.09 57.87 Favored 'General case' 0 N--CA 1.423 -1.8 0 CA-C-N 115.235 -0.893 . . . . 0.0 113.265 -174.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -107.34 -14.35 14.9 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 179.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.55 45.09 90.48 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.516 -0.634 . . . . 0.0 111.516 -176.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -112.74 -15.91 12.88 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 122.621 -0.341 . . . . 0.0 111.59 -175.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.82 16.8 20.75 Favored Glycine 0 N--CA 1.43 -1.708 0 CA-C-O 119.593 -0.559 . . . . 0.0 113.111 179.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 68.0 p -142.37 138.67 31.36 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 117.351 0.575 . . . . 0.0 109.804 173.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 67.8 mt -112.99 114.66 47.61 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 176.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.478 HG22 HG22 ' A' ' 62' ' ' THR . 37.2 p -84.41 174.04 10.41 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.162 -177.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.7 p -61.76 -32.83 73.12 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.613 0.721 . . . . 0.0 109.404 174.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -57.56 -55.05 39.9 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 114.639 -1.164 . . . . 0.0 109.051 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -67.23 -39.39 86.2 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.596 -177.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.2 mt -58.38 -50.6 73.1 Favored 'General case' 0 C--O 1.213 -0.821 0 O-C-N 123.133 0.27 . . . . 0.0 111.482 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.09 -30.76 76.24 Favored Glycine 0 C--O 1.214 -1.112 0 C-N-CA 119.488 -1.339 . . . . 0.0 111.836 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.1 m -64.2 -49.45 71.93 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 120.758 0.314 . . . . 0.0 110.456 176.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.1 m -70.22 -37.54 71.75 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.628 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.688 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtt -65.34 -37.74 87.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.73 -0.214 . . . . 0.0 111.09 178.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -63.92 -33.51 75.87 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.932 0.396 . . . . 0.0 110.078 177.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.8 m -71.01 -30.0 66.11 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.482 177.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -84.64 -19.19 33.3 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 110.29 35.74 2.07 Favored Glycine 0 N--CA 1.442 -0.911 0 C-N-CA 120.978 -0.629 . . . . 0.0 114.475 177.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.6 ' OE1' ' HD3' ' B' ' 96' ' ' PRO . 61.3 tt0 -140.06 132.16 27.98 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 171.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.408 HD22 ' N ' ' A' ' 42' ' ' ASN . 0.7 OUTLIER -116.49 83.81 13.97 Favored Pre-proline 0 C--N 1.289 -2.052 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 175.533 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.493 ' HG2' HD21 ' A' ' 48' ' ' LEU . 9.3 Cg_endo -86.96 156.64 8.59 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.583 2.189 . . . . 0.0 112.415 -179.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.3 t -82.45 158.29 23.3 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mp0 -59.6 -28.87 67.55 Favored 'General case' 0 C--O 1.21 -1.001 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -43.22 82.86 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.063 0.459 . . . . 0.0 110.696 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -69.21 -44.01 72.95 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.814 0.816 . . . . 0.0 109.456 -178.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.493 HD21 ' HG2' ' A' ' 43' ' ' PRO . 87.8 mt -63.72 -40.49 96.88 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.32 -178.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -64.33 -37.85 88.96 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.168 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -59.21 -42.43 90.95 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 123.708 0.63 . . . . 0.0 109.981 179.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.2 tpp -68.36 -52.99 27.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.949 177.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.1 mt -54.76 -49.15 71.06 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.749 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.629 -178.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.421 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 7.8 t30 -58.76 -20.75 52.4 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 123.953 0.901 . . . . 0.0 113.132 -172.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -73.74 -43.02 60.29 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-O 121.214 0.53 . . . . 0.0 110.068 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.678 HG11 ' HB2' ' A' ' 71' ' ' MET . 26.6 m -90.72 -15.41 8.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.896 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.421 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 27.3 t70 -81.57 88.78 6.18 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.681 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.79 -13.16 45.94 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -176.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -91.19 -10.33 42.09 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -178.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 74.15 29.02 63.12 Favored Glycine 0 N--CA 1.439 -1.106 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.512 177.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -96.35 -16.48 21.27 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 117.607 0.704 . . . . 0.0 111.784 177.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 78.69 23.34 64.79 Favored Glycine 0 N--CA 1.441 -1.013 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.7 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.478 HG22 HG22 ' A' ' 28' ' ' THR . 15.2 p -138.42 137.24 37.04 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 54.3 mt -89.61 110.37 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.963 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -175.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -79.89 162.6 24.91 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.494 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 68.3 t80 -52.84 -53.02 59.34 Favored Pre-proline 0 C--N 1.307 -1.252 0 CA-C-O 119.061 -0.495 . . . . 0.0 112.155 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -50.99 -42.23 53.28 Favored 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 122.679 2.253 . . . . 0.0 112.715 174.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -68.48 -35.88 78.17 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.265 0.555 . . . . 0.0 110.287 -179.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -66.29 -39.87 89.67 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 85.8 mt -63.21 -44.12 96.19 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.596 176.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 57.4 m -55.14 -50.18 69.91 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 123.676 0.61 . . . . 0.0 109.809 176.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.678 ' HB2' HG11 ' A' ' 55' ' ' VAL . 31.5 ttp -59.46 -45.32 91.95 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.603 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 31.8 tpp -67.62 -39.88 84.7 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.27 0.557 . . . . 0.0 110.842 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.11 -24.81 61.54 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.36 -178.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -75.63 -31.73 59.97 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.775 0.798 . . . . 0.0 108.947 172.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -74.46 -54.25 7.93 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.335 -174.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.459 ' HB3' ' HB2' ' A' ' 80' ' ' ASP . 20.9 ptp -71.25 142.48 50.55 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.257 -176.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 77' ' ' LYS . 9.6 mptt -119.6 79.55 1.45 Allowed 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 105.099 -2.186 . . . . 0.0 105.099 172.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.6 t70 61.94 83.05 0.16 Allowed 'General case' 0 C--N 1.319 -0.76 0 O-C-N 124.855 1.347 . . . . 0.0 108.701 -169.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 33.8 m 74.87 140.57 0.07 Allowed 'General case' 0 CA--C 1.561 1.378 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.655 -176.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.459 ' HB2' ' HB3' ' A' ' 76' ' ' MET . 21.7 t70 -120.72 94.09 4.24 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.3 m -137.26 -57.01 0.71 Allowed 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.346 178.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -80.95 -21.51 40.34 Favored 'General case' 0 CA--C 1.496 -1.133 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.306 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -50.86 -37.41 43.2 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -62.16 -46.03 90.76 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.488 0.661 . . . . 0.0 111.49 175.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.466 HG21 ' HA ' ' A' ' 142' ' ' VAL . 10.0 mm -70.61 -42.44 77.97 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.556 -176.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -69.34 -34.47 74.67 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.517 -1.22 . . . . 0.0 111.562 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.35 -48.62 79.0 Favored 'General case' 0 CA--C 1.495 -1.171 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.471 ' O ' ' HD2' ' A' ' 92' ' ' PHE . . . -61.0 -44.85 96.81 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 113.238 -1.801 . . . . 0.0 110.701 177.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -63.06 -47.31 83.5 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.086 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -58.17 -35.05 71.0 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 178.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.4 HG12 ' O ' ' A' ' 88' ' ' ALA . 7.9 p -76.59 -28.28 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.278 -178.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.471 ' HD2' ' O ' ' A' ' 88' ' ' ALA . 73.8 m-85 -86.63 -42.29 13.56 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.885 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -73.59 85.56 1.59 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.941 0.877 . . . . 0.0 109.411 177.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -79.44 -42.7 24.81 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 114.547 -1.206 . . . . 0.0 111.952 -175.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.22 -13.03 51.2 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.859 -175.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.05 54.57 4.07 Favored Glycine 0 C--N 1.307 -1.075 0 C-N-CA 120.149 -1.024 . . . . 0.0 110.558 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -100.22 -19.96 16.15 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.06 2.03 88.36 Favored Glycine 0 C--O 1.24 0.499 0 N-CA-C 110.24 -1.144 . . . . 0.0 110.24 -177.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.515 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 42.4 m-85 -142.22 130.75 22.53 Favored 'General case' 0 N--CA 1.425 -1.686 0 C-N-CA 126.262 1.825 . . . . 0.0 106.38 -178.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.436 ' HB ' HG13 ' A' ' 136' ' ' VAL . 3.0 mt -81.19 126.98 39.91 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.6 t -94.33 150.54 20.18 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.68 -44.88 80.61 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.631 0.253 . . . . 0.0 111.136 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.27 -34.87 78.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.414 0.626 . . . . 0.0 109.643 178.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -67.17 -45.97 75.39 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.057 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.9 tt -63.6 -40.0 95.82 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 179.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? -61.66 -39.84 92.8 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -58.32 -49.75 76.08 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.629 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.488 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 6.9 p -68.06 -30.16 47.13 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.667 0 C-N-CA 120.327 -0.549 . . . . 0.0 109.795 -179.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.8 mmt -63.96 -42.25 97.34 Favored 'General case' 0 CA--C 1.491 -1.299 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.7 m -66.4 -32.44 73.82 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -73.56 -29.01 62.16 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.652 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 79.5 mt -91.2 -9.8 44.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.388 0.613 . . . . 0.0 110.165 -178.049 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 75.9 20.37 77.92 Favored Glycine 0 N--CA 1.435 -1.405 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.363 179.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -76.56 -27.53 55.93 Favored 'General case' 0 CA--C 1.495 -1.156 0 CA-C-N 116.98 0.39 . . . . 0.0 110.951 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.6 mttt 59.96 42.64 15.79 Favored 'General case' 0 C--O 1.236 0.362 0 O-C-N 124.32 1.013 . . . . 0.0 111.689 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 58.5 mt -86.27 154.8 21.0 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.476 ' H ' ' CD ' ' A' ' 120' ' ' GLU . 20.7 p -101.78 177.31 4.94 Favored 'General case' 0 N--CA 1.426 -1.626 0 C-N-CA 119.061 -1.056 . . . . 0.0 110.743 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.433 ' HA ' HG22 ' A' ' 121' ' ' VAL . 6.3 p-10 -65.21 -18.55 65.4 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.145 0.498 . . . . 0.0 110.853 -177.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -70.69 -57.05 5.09 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.472 -177.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.476 ' CD ' ' H ' ' A' ' 117' ' ' THR . 3.5 pm0 -70.08 -35.52 74.25 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.336 -177.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.486 ' O ' HG12 ' A' ' 125' ' ' ILE . 5.9 m -70.93 -26.56 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.42 -178.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -72.82 -35.64 67.34 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -67.48 -36.0 80.27 Favored 'General case' 0 C--N 1.352 0.704 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 176.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.42 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 65.2 mtt -55.15 -46.56 75.71 Favored 'General case' 0 CA--C 1.509 -0.608 0 O-C-N 124.145 0.903 . . . . 0.0 109.933 176.271 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.486 HG12 ' O ' ' A' ' 121' ' ' VAL . 51.2 mm -66.32 -53.99 30.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.258 177.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -45.82 -59.66 2.67 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 126.274 1.83 . . . . 0.0 114.555 -174.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.67 ' HB2' ' CE1' ' B' ' 81' ' ' PHE . 12.2 mm-40 -69.44 -20.08 63.77 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.921 0.391 . . . . 0.0 111.64 -176.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -92.31 -21.26 20.38 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.636 0.732 . . . . 0.0 110.154 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -79.6 73.26 6.3 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-O 122.323 1.059 . . . . 0.0 110.282 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.424 ' HB ' ' HG3' ' A' ' 140' ' ' GLU . 27.9 mt -82.98 -9.71 11.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 CA-C-N 114.605 -1.18 . . . . 0.0 108.757 176.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -84.8 -11.84 54.9 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.46 0.648 . . . . 0.0 109.537 -178.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 65.7 36.26 92.11 Favored Glycine 0 N--CA 1.436 -1.313 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.453 177.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -101.29 -16.38 16.96 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.329 0.585 . . . . 0.0 110.289 -176.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.15 0.25 68.19 Favored Glycine 0 C--N 1.312 -0.796 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -176.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.515 ' HB3' ' HB3' ' A' ' 99' ' ' TYR . 21.3 mt-30 -144.36 138.91 28.15 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.436 HG13 ' HB ' ' A' ' 100' ' ' ILE . 1.3 p -83.45 118.98 31.93 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -176.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.423 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 37.7 t30 -73.8 156.3 37.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.788 1.235 . . . . 0.0 110.489 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.467 ' O ' HG13 ' A' ' 142' ' ' VAL . 80.2 t80 -56.81 -48.79 77.18 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 122.738 0.415 . . . . 0.0 111.725 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.441 ' O ' HG22 ' A' ' 142' ' ' VAL . 27.0 mm-40 -65.98 -33.93 76.94 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.994 0.426 . . . . 0.0 111.971 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.424 ' HG3' ' HB ' ' A' ' 130' ' ' ILE . 1.3 mp0 -71.67 -34.5 69.76 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 121.219 0.533 . . . . 0.0 110.157 175.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -68.34 -42.46 79.24 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.81 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.467 HG13 ' O ' ' A' ' 138' ' ' TYR . 8.9 m -63.58 -36.61 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 120.283 -0.567 . . . . 0.0 109.646 178.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -64.7 -49.5 70.64 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.712 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -69.41 -44.61 71.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.515 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.7 tpt -65.66 -38.04 88.22 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 111.455 0.169 . . . . 0.0 111.455 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 74.5 m -81.15 -8.69 59.81 Favored 'General case' 0 CA--C 1.559 1.312 0 CA-C-O 121.258 0.552 . . . . 0.0 110.469 177.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.57 102.99 8.22 Favored 'General case' 0 C--O 1.249 1.076 0 O-C-N 121.811 -0.555 . . . . 0.0 110.042 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm . . . . . 0 C--O 1.254 1.297 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.138 178.898 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.448 -0.53 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -80.28 10.99 3.0 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.236 2.624 . . . . 0.0 112.71 -178.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.441 ' HB3' ' HB2' ' B' ' 81' ' ' PHE . . . -50.17 115.22 1.33 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.619 1.168 . . . . 0.0 113.047 -177.001 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 55.65 -87.23 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 126.255 1.822 . . . . 0.0 113.9 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 44.7 m -99.21 23.4 9.21 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.241 0.543 . . . . 0.0 109.596 -179.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 66.58 23.09 10.43 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.811 1.244 . . . . 0.0 110.37 177.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . 0.413 ' HB3' ' HB2' ' B' ' 83' ' ' GLU . 42.9 m80 -140.72 92.13 2.48 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.778 -178.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . 0.67 ' CE1' ' HB2' ' A' ' 127' ' ' GLU . 89.3 t80 -86.52 -39.27 16.4 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -64.16 -50.41 68.27 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.896 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . 0.413 ' HB2' ' HB3' ' B' ' 80' ' ' HIS . 24.4 mp0 -61.96 -35.72 79.31 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 123.099 0.559 . . . . 0.0 110.273 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.406 ' HB1' ' HE2' ' A' ' 124' ' ' MET . . . -60.25 -55.83 28.95 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.474 179.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.565 ' O ' HG12 ' B' ' 89' ' ' ILE . 35.9 m95 -67.43 -37.56 83.21 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 177.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -54.37 -56.78 15.17 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -63.14 -27.83 69.64 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.259 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.36 -55.16 8.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.618 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.565 HG12 ' O ' ' B' ' 85' ' ' TRP . 44.7 mm -57.38 -50.53 76.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.831 0.824 . . . . 0.0 109.188 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . 0.562 ' NE2' ' HB2' ' A' ' 41' ' ' GLN . 29.9 tt0 -61.51 -43.29 99.13 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 113.949 -1.478 . . . . 0.0 112.278 -176.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -76.15 -31.46 58.58 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.325 -0.55 . . . . 0.0 111.337 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.09 -38.08 89.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.545 0.688 . . . . 0.0 109.621 177.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 38.0 mttm -74.86 -32.12 61.8 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.599 175.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 27.9 t60 90.67 -27.64 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 127.686 2.394 . . . . 0.0 109.778 -176.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 25.7 mmt -137.98 151.1 69.47 Favored Pre-proline 0 C--N 1.303 -1.451 0 N-CA-C 105.839 -1.912 . . . . 0.0 105.839 177.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.6 ' HD3' ' OE1' ' A' ' 41' ' ' GLN . 12.5 Cg_exo -70.19 -17.98 35.26 Favored 'Trans proline' 0 C--O 1.223 -0.236 0 C-N-CA 121.186 1.258 . . . . 0.0 109.93 176.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . 0.402 ' HA ' ' HD3' ' B' ' 98' ' ' PRO . 29.0 m-20 82.18 137.34 0.05 OUTLIER Pre-proline 0 CA--C 1.51 -0.591 0 C-N-CA 126.605 1.962 . . . . 0.0 111.124 -175.568 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' B' ' 97' ' ' ASP . 4.7 Cg_exo -76.7 101.59 1.52 Allowed 'Trans proline' 0 N--CA 1.443 -1.486 0 C-N-CA 121.439 1.426 . . . . 0.0 109.786 176.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -82.59 161.14 22.36 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.612 0.72 . . . . 0.0 111.007 -178.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.414 -2.267 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 172.914 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.69 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -145.25 -9.76 0.57 Allowed 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -110.65 153.92 24.55 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.442 ' HB3' HD11 ' A' ' 9' ' ' ILE . 20.1 tp -132.57 158.17 42.85 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -176.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.1 p -77.31 151.03 35.19 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.585 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -59.09 -36.1 74.55 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -176.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -58.85 -52.83 64.06 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-O 121.261 0.553 . . . . 0.0 109.72 177.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -62.58 -46.69 87.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.032 -177.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.515 ' O ' ' HG3' ' A' ' 13' ' ' LYS . 75.2 mt -60.0 -36.71 68.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 O-C-N 123.588 0.555 . . . . 0.0 111.084 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.19 -44.93 86.83 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-O 120.647 0.26 . . . . 0.0 110.527 177.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -61.57 -36.63 81.19 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.717 176.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.475 ' CZ ' ' HG2' ' A' ' 72' ' ' MET . 56.0 m-85 -72.32 -33.94 67.71 Favored 'General case' 0 C--O 1.185 -2.323 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 177.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 9' ' ' ILE . 99.2 mttt -59.03 -42.99 91.54 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.756 0.788 . . . . 0.0 109.794 176.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.34 -54.46 40.17 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.592 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.9 -31.44 69.23 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.042 -176.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -63.11 -48.25 79.33 Favored 'General case' 0 C--O 1.206 -1.237 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 177.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -68.84 -17.33 63.98 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.251 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.6 tp -72.0 -31.8 66.58 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.414 0.626 . . . . 0.0 110.04 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.49 ' CD2' HG21 ' A' ' 35' ' ' VAL . 10.5 m-85 -95.75 -35.86 11.39 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.114 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -77.64 99.38 5.77 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 175.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -64.69 -21.89 66.85 Favored 'General case' 0 C--N 1.307 -1.251 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -173.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.438 ' OD2' ' HB3' ' A' ' 24' ' ' ASP . 7.5 p-10 -113.12 -13.32 13.04 Favored 'General case' 0 C--N 1.305 -1.353 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.517 179.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.33 57.01 7.89 Favored Glycine 0 C--O 1.242 0.62 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.686 176.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.438 ' HB3' ' OD2' ' A' ' 22' ' ' ASP . 2.9 p-10 -112.91 -13.93 13.09 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 120.956 0.407 . . . . 0.0 110.518 -177.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.28 6.95 44.17 Favored Glycine 0 N--CA 1.433 -1.545 0 C-N-CA 121.172 -0.537 . . . . 0.0 112.79 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.447 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 74.6 p -137.78 131.27 30.97 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 117.288 0.544 . . . . 0.0 109.68 175.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.3 mt -102.26 124.99 56.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.993 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 177.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 27.0 p -94.3 167.7 11.37 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.294 178.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 40.0 p -64.82 -26.36 68.31 Favored 'General case' 0 C--O 1.242 0.706 0 CA-C-O 120.901 0.381 . . . . 0.0 110.238 177.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.1 tptp -55.32 -60.65 3.11 Favored 'General case' 0 C--O 1.242 0.668 0 C-N-CA 124.16 0.984 . . . . 0.0 108.941 174.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.88 -42.95 98.94 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 113.986 -1.461 . . . . 0.0 109.873 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -56.43 -61.73 2.21 Favored 'General case' 0 C--O 1.212 -0.884 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.878 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.17 -31.84 82.11 Favored Glycine 0 C--N 1.309 -0.969 0 C-N-CA 119.303 -1.427 . . . . 0.0 113.43 -174.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.6 m -67.59 -44.46 78.06 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 116.864 0.332 . . . . 0.0 111.068 178.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.514 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 31.3 m -71.48 -35.98 58.84 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.257 0 C-N-CA 119.699 -0.801 . . . . 0.0 110.152 178.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -64.11 -44.4 92.38 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.866 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -64.69 -33.42 75.9 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.86 0.362 . . . . 0.0 110.198 178.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 m -70.77 -21.46 62.5 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.091 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 35' ' ' VAL . 92.2 mt -88.98 -22.77 22.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.71 0.291 . . . . 0.0 110.45 177.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.89 3.44 31.93 Favored Glycine 0 C--N 1.314 -0.693 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.728 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.457 ' C ' HD22 ' A' ' 42' ' ' ASN . 10.2 tp60 -101.47 131.47 47.58 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.304 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.457 HD22 ' C ' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -121.47 79.87 37.84 Favored Pre-proline 0 C--N 1.298 -1.658 0 C-N-CA 119.709 -0.796 . . . . 0.0 112.704 177.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -78.81 153.97 26.2 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 121.703 1.602 . . . . 0.0 108.675 169.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.433 ' OG1' ' HG2' ' A' ' 47' ' ' GLU . 47.6 p -81.85 173.33 12.36 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.134 -178.02 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -59.12 -40.76 86.42 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 123.827 0.851 . . . . 0.0 110.658 -176.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.43 -35.87 68.43 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.248 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.433 ' HG2' ' OG1' ' A' ' 44' ' ' THR . 23.0 mm-40 -60.51 -47.97 83.8 Favored 'General case' 0 C--O 1.241 0.607 0 O-C-N 123.502 0.501 . . . . 0.0 110.943 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.444 ' O ' HG13 ' A' ' 52' ' ' ILE . 78.9 mt -62.43 -41.06 98.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.129 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -67.52 -36.57 81.29 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.548 -177.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -67.57 -42.03 83.23 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.013 0.435 . . . . 0.0 109.983 178.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.758 ' SD ' ' HA ' ' B' ' 96' ' ' PRO . 46.5 tpp -60.06 -36.8 78.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.97 -1.013 . . . . 0.0 109.653 178.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 48' ' ' LEU . 49.0 mt -65.84 -50.21 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.143 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.4 175.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.504 ' HA ' ' HB3' ' A' ' 56' ' ' ASP . 9.0 t30 -60.98 -23.39 65.32 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -174.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.68 -44.4 73.32 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 123.98 0.912 . . . . 0.0 109.238 175.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.8 m -105.6 -15.49 8.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -177.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.504 ' HB3' ' HA ' ' A' ' 53' ' ' ASN . 27.7 t0 -72.17 103.8 3.44 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.062 0.458 . . . . 0.0 111.581 -176.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.07 -21.61 25.95 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.325 -179.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -83.05 -12.08 57.48 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.277 -174.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 62.8 29.84 75.22 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 -173.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -100.12 -8.98 23.05 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.199 0.523 . . . . 0.0 110.853 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 86.82 12.83 68.07 Favored Glycine 0 N--CA 1.432 -1.602 0 CA-C-N 115.856 -0.611 . . . . 0.0 114.018 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.447 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 53.9 p -132.35 150.86 52.07 Favored 'General case' 0 C--O 1.255 1.363 0 CA-C-N 117.919 0.859 . . . . 0.0 111.124 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.405 HG13 HG12 ' A' ' 52' ' ' ILE . 86.1 mt -91.76 112.35 25.45 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.719 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 179.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -80.28 153.11 28.68 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 175.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.421 ' N ' ' HD2' ' A' ' 66' ' ' PRO . 31.2 t80 -53.03 -50.15 83.51 Favored Pre-proline 0 CA--C 1.553 1.096 0 O-C-N 123.429 0.456 . . . . 0.0 111.93 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 65' ' ' PHE . 5.1 Cg_endo -49.72 -47.55 22.62 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.653 2.235 . . . . 0.0 112.872 173.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -62.74 -41.42 99.17 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 121.786 0.803 . . . . 0.0 110.425 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.555 ' CZ ' ' HB3' ' B' ' 100' ' ' ALA . 4.9 t80 -61.43 -43.97 97.95 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.382 176.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 92.6 mt -62.91 -35.11 78.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.937 178.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.9 m -58.68 -53.54 57.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 122.617 0.367 . . . . 0.0 111.191 178.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -64.97 -31.55 72.84 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.856 -177.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.475 ' HG2' ' CZ ' ' A' ' 12' ' ' PHE . 13.1 tpp -79.21 -38.75 34.95 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 119.66 -0.816 . . . . 0.0 110.978 -176.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.75 -24.31 62.59 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-O 120.682 0.277 . . . . 0.0 110.942 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -72.34 -27.34 62.35 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 121.244 0.545 . . . . 0.0 110.289 174.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.599 ' HD2' ' SD ' ' B' ' 95' ' ' MET . 47.6 tttp -78.68 -47.76 16.34 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 176.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 65.6 mtp -83.12 62.74 6.78 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 113.976 -1.465 . . . . 0.0 110.927 -177.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -125.34 -169.72 2.04 Favored 'General case' 0 N--CA 1.41 -2.439 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 177.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -81.73 97.09 7.77 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 175.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.4 m -87.96 86.01 7.07 Favored 'General case' 0 N--CA 1.419 -1.994 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 176.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -90.89 3.07 55.55 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 114.715 -1.129 . . . . 0.0 110.581 -175.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 58.9 p -102.48 -176.91 3.24 Favored 'General case' 0 N--CA 1.402 -2.836 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.17 3.87 46.62 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.54 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 47.5 mt-10 -53.59 -63.4 1.16 Allowed 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -170.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -83.95 -21.65 31.73 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 121.739 0.78 . . . . 0.0 109.589 -176.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.4 mm -66.75 -47.33 83.26 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.407 -172.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -73.28 -30.5 63.45 Favored 'General case' 0 N--CA 1.423 -1.82 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.45 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 83' ' ' GLU . 39.4 mt-10 -64.63 -46.22 83.48 Favored 'General case' 0 C--O 1.247 0.938 0 C-N-CA 119.978 -0.689 . . . . 0.0 110.115 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.455 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -67.68 -42.51 81.99 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.274 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -60.06 -45.63 92.24 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 178.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -60.85 -31.08 70.53 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.649 0.78 . . . . 0.0 112.465 -179.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 88' ' ' ALA . 14.5 p -79.52 -27.27 12.78 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 C-N-CA 119.173 -1.011 . . . . 0.0 111.63 -179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -82.14 -52.53 6.9 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -87.84 81.47 7.56 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 122.558 1.17 . . . . 0.0 108.159 175.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -76.09 -29.71 58.04 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 113.24 -1.8 . . . . 0.0 110.575 -174.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -73.97 -13.79 60.93 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.198 0.523 . . . . 0.0 110.72 178.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 66.24 42.83 93.98 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.981 -0.554 . . . . 0.0 113.491 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -98.56 -10.7 23.05 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 122.576 -0.367 . . . . 0.0 111.91 -179.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 102.19 4.45 50.55 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.357 -0.925 . . . . 0.0 113.24 174.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -151.99 132.42 13.78 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-O 121.168 0.509 . . . . 0.0 111.266 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.469 ' HB ' HG13 ' A' ' 136' ' ' VAL . 4.1 mt -79.11 128.59 38.43 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 -177.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.6 t -113.61 145.32 41.45 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 176.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.49 -50.45 62.71 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -173.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.36 -44.08 84.06 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 123.278 0.361 . . . . 0.0 111.86 -177.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -71.89 -37.74 70.08 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.992 -179.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.491 ' O ' ' HG2' ' A' ' 109' ' ' MET . 5.1 tt -60.59 -43.5 97.3 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 178.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -64.41 -45.53 87.21 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 23.2 t-80 -59.2 -46.95 87.08 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.391 -178.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.546 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 8.2 p -66.38 -36.69 77.95 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.131 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.724 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.491 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 21.5 mmt -59.88 -42.27 93.4 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-O 120.699 0.285 . . . . 0.0 111.552 178.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 16.4 m -62.07 -35.42 78.6 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.633 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -74.39 -32.38 62.69 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.371 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.66 HD13 ' HA ' ' B' ' 92' ' ' ALA . 60.9 mt -84.9 -20.14 31.21 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.722 -174.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.68 35.61 6.8 Favored Glycine 0 N--CA 1.423 -2.179 0 C-N-CA 119.773 -1.204 . . . . 0.0 111.792 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.546 ' OE1' ' HG2' ' B' ' 91' ' ' LYS . 11.0 tp10 -120.19 111.98 18.51 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 176.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -80.28 94.36 6.08 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.767 -178.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.465 HD21 ' HG3' ' A' ' 114' ' ' GLU . 15.0 mt -119.89 132.3 55.51 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 105.735 -1.95 . . . . 0.0 105.735 176.033 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.4 p -94.27 -176.86 4.09 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 118.552 -1.259 . . . . 0.0 109.783 178.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -56.46 -42.07 77.57 Favored 'General case' 0 C--O 1.208 -1.098 0 C-N-CA 123.374 0.67 . . . . 0.0 111.585 -175.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -69.62 -24.7 63.69 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 113.399 0.888 . . . . 0.0 113.399 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -79.43 -46.91 16.63 Favored 'General case' 0 CA--C 1.499 -0.998 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.585 175.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.49 ' O ' HG12 ' A' ' 125' ' ' ILE . 13.9 m -65.67 -34.85 73.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.92 -43.13 99.64 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 123.516 0.726 . . . . 0.0 110.453 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -65.98 -40.93 91.65 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.401 ' HB3' ' CZ2' ' B' ' 85' ' ' TRP . 64.2 mtt -60.87 -41.05 95.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.235 178.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.49 HG12 ' O ' ' A' ' 121' ' ' VAL . 46.0 mm -65.26 -53.03 45.14 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.804 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -56.32 -40.7 74.82 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.359 0.664 . . . . 0.0 112.426 -175.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -79.57 -8.17 58.99 Favored 'General case' 0 C--N 1.309 -1.189 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.505 ' HB1' HG21 ' A' ' 136' ' ' VAL . . . -108.76 -22.58 12.16 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-O 121.3 0.572 . . . . 0.0 110.294 177.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -71.64 95.92 1.51 Allowed 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 125.087 1.355 . . . . 0.0 109.479 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 63.3 mt -83.74 -48.69 17.05 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.167 -177.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -86.13 -11.3 53.0 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -172.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 84.7 66.87 1.44 Allowed Glycine 0 C--N 1.296 -1.647 0 C-N-CA 120.233 -0.984 . . . . 0.0 112.837 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -112.19 -16.35 13.02 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 177.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.06 5.41 67.92 Favored Glycine 0 CA--C 1.506 -0.516 0 N-CA-C 109.191 -1.563 . . . . 0.0 109.191 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -151.22 151.25 31.61 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.883 1.673 . . . . 0.0 106.868 -176.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.505 HG21 ' HB1' ' A' ' 128' ' ' ALA . 0.8 OUTLIER -104.28 116.2 47.63 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.971 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -176.689 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -78.49 161.09 27.32 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.528 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.432 ' O ' HG13 ' A' ' 142' ' ' VAL . 81.8 t80 -55.58 -45.24 77.41 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 123.165 0.586 . . . . 0.0 112.045 -177.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.418 ' O ' HG22 ' A' ' 142' ' ' VAL . 38.2 mm-40 -66.91 -21.47 65.99 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -84.32 -38.09 20.81 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 175.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -74.5 -25.03 59.1 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.681 -177.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.432 HG13 ' O ' ' A' ' 138' ' ' TYR . 35.1 m -56.42 -27.94 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-O 121.116 0.484 . . . . 0.0 110.623 176.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -78.11 -64.3 1.19 Allowed 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 176.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.526 ' HA ' ' O ' ' A' ' 147' ' ' ALA . 16.2 tpt -57.36 -28.72 63.41 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -171.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -57.13 -51.81 67.82 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.324 0.583 . . . . 0.0 110.028 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 19.8 m -99.82 -38.73 8.53 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.657 -177.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.526 ' O ' ' HA ' ' A' ' 144' ' ' MET . . . -94.44 104.42 16.38 Favored 'General case' 0 CA--C 1.505 -0.759 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 43.9 mttp . . . . . 0 C--N 1.296 -1.732 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -177.044 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 40.7 m . . . . . 0 CA--C 1.556 1.181 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -100.58 13.81 0.46 Allowed 'Trans proline' 0 C--N 1.375 1.965 0 CA-C-N 121.338 1.513 . . . . 0.0 112.86 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' B' ' 81' ' ' PHE . . . -97.66 -33.21 11.4 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.003 -176.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . 0.484 ' HA ' ' CG ' ' B' ' 81' ' ' PHE . 30.8 p-10 -75.95 -11.07 59.89 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.381 0.61 . . . . 0.0 110.685 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 12.6 m -70.13 -44.0 69.81 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.874 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -143.96 141.53 30.24 Favored 'General case' 0 CA--C 1.515 -0.389 0 O-C-N 122.056 -0.403 . . . . 0.0 110.566 -176.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 46.5 t60 71.2 3.75 4.78 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.359 1.064 . . . . 0.0 112.205 173.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' PHE . . . . . 0.484 ' CG ' ' HA ' ' B' ' 77' ' ' ASN . 67.8 t80 -75.6 -30.5 59.6 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.6 0.714 . . . . 0.0 109.995 -177.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -60.47 -49.17 78.61 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.66 -1.155 . . . . 0.0 109.23 175.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -71.34 -27.26 63.25 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.601 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.53 -53.45 54.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.965 179.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.401 ' CZ2' ' HB3' ' A' ' 124' ' ' MET . 32.2 m95 -67.36 -35.61 79.71 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 177.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -52.41 -55.37 22.23 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.181 0.925 . . . . 0.0 108.636 177.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -68.17 -38.56 82.21 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-N 114.129 -1.396 . . . . 0.0 112.581 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.35 -50.41 71.58 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -176.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 27.3 pt -72.9 -19.72 18.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.516 0.674 . . . . 0.0 112.456 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -79.16 -49.67 12.21 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-O 121.981 0.896 . . . . 0.0 109.535 175.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.546 ' HG2' ' OE1' ' A' ' 114' ' ' GLU . 18.5 tptm -71.39 -53.97 12.28 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 125.939 1.696 . . . . 0.0 113.596 -175.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.66 ' HA ' HD13 ' A' ' 112' ' ' LEU . . . -54.27 -51.92 63.02 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -169.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -78.91 3.1 17.98 Favored 'General case' 0 N--CA 1.417 -2.105 0 O-C-N 122.13 -0.356 . . . . 0.0 111.378 -177.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 54.44 65.02 1.62 Allowed 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 124.526 1.13 . . . . 0.0 108.566 -175.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 95' ' ' MET . . . . . 0.599 ' SD ' ' HD2' ' A' ' 75' ' ' LYS . 13.1 ttt -74.46 -66.19 0.49 Allowed Pre-proline 0 N--CA 1.438 -1.053 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.028 -179.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.758 ' HA ' ' SD ' ' A' ' 51' ' ' MET . 31.2 Cg_endo -104.39 -166.4 0.04 OUTLIER 'Trans proline' 0 N--CA 1.416 -3.084 0 N-CA-C 108.493 -1.387 . . . . 0.0 108.493 169.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . 0.613 ' H ' ' HD2' ' B' ' 98' ' ' PRO . 11.4 m-20 -106.81 -47.34 0.11 Allowed Pre-proline 0 C--N 1.282 -2.369 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.26 169.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . 0.613 ' HD2' ' H ' ' B' ' 97' ' ' ASP . 36.6 Cg_endo -69.29 95.22 0.51 Allowed 'Trans proline' 0 C--N 1.377 2.034 0 CA-C-N 120.825 1.33 . . . . 0.0 110.262 172.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . 0.456 ' CD2' ' HD3' ' B' ' 91' ' ' LYS . 5.7 m-90 -81.39 78.58 8.15 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.158 0.98 . . . . 0.0 111.37 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . 0.555 ' HB3' ' CZ ' ' A' ' 68' ' ' PHE . . . . . . . . 0 N--CA 1.4 -2.939 0 CA-C-N 114.028 -1.442 . . . . 0.0 107.562 -177.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_